The list below displays all identified metabolites that are currently screened by the Fiehn laboratory. It is best used by querying the structure keys, as many names are non-trivial and the list below does not comprise synonyms. A further option is to query for PubChem CIDs. However, different stereoconfigurations are annotated by different PubChem CIDs, and we have not always used stereoinformation below. Again, the best way to compare compound lists is by structures, specifically InChI codes.
We are continually extending the compound list and welcome compound donations or compound structures and names with PubChem CIDs that are yet missing in our lists. For additional information please visit the FiehnLib 2009 website.
If you are interested in the corresponding mass spectra, you can purchase the Fiehn libraries for GC-quadrupole mass spectrometers from Agilent, and for GC-TOF mass spectrometers from Leco.
You can also directly compare mass spectra by compound names, by database identifiers or even against your own GC/MS spectra by querying BinBase.
1 | 154.12 | C7H6O4 | ![]() |
CID: 19 | 2,3-dihydroxybenzoic acid | GLDQAMYCGOIJDV-UHFFFAOYSA-N |
2 | 176.16 | C7H12O5 | ![]() |
CID: 36 | 2-hydroxy-3-isopropylbutanedioic acid | RNQHMTFBUSSBJQ-UHFFFAOYSA-N |
3 | 128.12 | C6H8O3 | ![]() |
CID: 39 | 4,4-dimethyltetrahydrofuran-2,3-dione | HRTOQFBQOFIFEE-UHFFFAOYSA-N |
4 | 120.06 | C3H4O5 | ![]() |
CID: 45 | 2-hydroxypropanedioic acid | ROBFUDYVXSDBQM-UHFFFAOYSA-N |
5 | 116.11 | C5H8O3 | ![]() |
CID: 49 | 3-methyl-2-oxobutanoic acid | QHKABHOOEWYVLI-UHFFFAOYSA-N |
6 | 146.09 | C5H6O5 | ![]() |
CID: 51 | 2-oxopentanedioic acid | KPGXRSRHYNQIFN-UHFFFAOYSA-N |
7 | 102.08 | C4H6O3 | ![]() |
CID: 58 | 2-oxobutanoic acid | TYEYBOSBBBHJIV-UHFFFAOYSA-N |
8 | 130.14 | C6H10O3 | ![]() |
CID: 70 | 4-methyl-2-oxopentanoic acid | BKAJNAXTPSGJCU-UHFFFAOYSA-N |
9 | 160.12 | C6H8O5 | ![]() |
CID: 71 | 2-oxohexanedioic acid | FGSBNBBHOZHUBO-UHFFFAOYSA-N |
10 | 154.12 | C7H6O4 | ![]() |
CID: 72 | 3,4-dihydroxybenzoic acid | YQUVCSBJEUQKSH-UHFFFAOYSA-N |
11 | 288.42 | C19H28O2 | ![]() |
CID: 76 | 3-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one | FMGSKLZLMKYGDP-UHFFFAOYSA-N |
12 | 172.13 | C7H8O5 | ![]() |
CID: 80 | 4,5-dihydroxy-3-oxo-1-cyclohexenecarboxylic acid | SLWWJZMPHJJOPH-UHFFFAOYSA-N |
13 | 153.13 | C7H7NO3 | ![]() |
CID: 86 | 2-amino-3-hydroxybenzoic acid | WJXSWCUQABXPFS-UHFFFAOYSA-N |
14 | 166.17 | C9H10O3 | ![]() |
CID: 91 | 3-(3-hydroxyphenyl)propanoic acid | QVWAEZJXDYOKEH-UHFFFAOYSA-N |
15 | 122.12 | C7H6O2 | ![]() |
CID: 101 | 3-hydroxybenzaldehyde | IAVREABSGIHHMO-UHFFFAOYSA-N |
16 | 124.13 | C7H8O2 | ![]() |
CID: 102 | 3-(hydroxymethyl)phenol | OKVJCVWFVRATSG-UHFFFAOYSA-N |
17 | 150.17 | C9H10O2 | ![]() |
CID: 107 | 3-phenylpropanoic acid | XMIIGOLPHOKFCH-UHFFFAOYSA-N |
18 | 132.11 | C4H8N2O3 | ![]() |
CID: 111 | 3-ureidopropanoic acid | JSJWCHRYRHKBBW-UHFFFAOYSA-N |
19 | 103.11 | C4H9NO2 | ![]() |
CID: 119 | 4-aminobutanoic acid | BTCSSZJGUNDROE-UHFFFAOYSA-N |
20 | 122.12 | C7H6O2 | ![]() |
CID: 126 | 4-hydroxybenzaldehyde | RGHHSNMVTDWUBI-UHFFFAOYSA-N |
21 | 152.14 | C8H8O3 | ![]() |
CID: 127 | 2-(4-hydroxyphenyl)acetic acid | XQXPVVBIMDBYFF-UHFFFAOYSA-N |
22 | 138.12 | C7H6O3 | ![]() |
CID: 135 | 4-hydroxybenzoic acid | FJKROLUGYXJWQN-UHFFFAOYSA-N |
23 | 117.14 | C5H11NO2 | ![]() |
CID: 138 | 5-aminopentanoic acid | JJMDCOVWQOJGCB-UHFFFAOYSA-N |
24 | 220.22 | C11H12N2O3 | ![]() |
CID: 144 | 2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acid | LDCYZAJDBXYCGN-UHFFFAOYSA-N |
25 | 352.46 | C20H32O5 | ![]() |
CID: 158 | 7-[3-hydroxy-2-(3-hydroxyoct-1-enyl)-5-oxocyclopentyl]-5-heptenoic acid | XEYBRNLFEZDVAW-UHFFFAOYSA-N |
26 | 147.12 | C5H9NO4 | ![]() |
CID: 189 | 3-acetoxy-2-aminopropanoic acid | VZXPDPZARILFQX-UHFFFAOYSA-N |
27 | 135.12 | C5H5N5 | ![]() |
CID: 190 | 7H-purin-6-amine | GFFGJBXGBJISGV-UHFFFAOYSA-N |
28 | 267.24 | C10H13N5O4 | ![]() |
CID: 191 | 2-(6-amino-9-purinyl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol | OIRDTQYFTABQOQ-UHFFFAOYSA-N |
29 | 146.14 | C6H10O4 | ![]() |
CID: 196 | adipic acid | WNLRTRBMVRJNCN-UHFFFAOYSA-N |
30 | 176.13 | C4H8N4O4 | ![]() |
CID: 203 | 2,2-diureidoacetic acid | NUCLJNSWZCHRKL-UHFFFAOYSA-N |
31 | 158.11 | C4H6N4O3 | ![]() |
CID: 204 | (2,5-dioxo-4-imidazolidinyl)urea | POJWUDADGALRAB-UHFFFAOYSA-N |
32 | 119.11 | C4H9NO3 | ![]() |
CID: 205 | 2-amino-3-hydroxybutanoic acid | AYFVYJQAPQTCCC-UHFFFAOYSA-N |
33 | 180.15 | C6H12O6 | ![]() |
CID: 206 | 6-(hydroxymethyl)tetrahydropyran-2,3,4,5-tetrol | WQZGKKKJIJFFOK-UHFFFAOYSA-N |
34 | 347.22 | C10H14N5O7P | ![]() |
CID: 224 | [5-(6-amino-9-purinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate | UDMBCSSLTHHNCD-UHFFFAOYSA-N |
35 | 290.44 | C19H30O2 | ![]() |
CID: 225 | 3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one | QGXBDMJGAMFCBF-UHFFFAOYSA-N |
36 | 176.12 | C6H8O6 | ![]() |
CID: 235 | 2-(1,2-dihydroxyethyl)-4,5-dihydroxy-3-furanone | TYQCGQRIZGCHNB-UHFFFAOYSA-N |
37 | 132.11 | C4H8N2O3 | ![]() |
CID: 236 | 2,4-diamino-4-oxobutanoic acid | DCXYFEDJOCDNAF-UHFFFAOYSA-N |
38 | 89.093 | C3H7NO2 | ![]() |
CID: 239 | 3-aminopropanoic acid | UCMIRNVEIXFBKS-UHFFFAOYSA-N |
39 | 106.12 | C7H6O | ![]() |
CID: 240 | benzaldehyde | HUMNYLRZRPPJDN-UHFFFAOYSA-N |
40 | 122.12 | C7H6O2 | ![]() |
CID: 243 | benzoic acid | WPYMKLBDIGXBTP-UHFFFAOYSA-N |
41 | 108.13 | C7H8O | ![]() |
CID: 244 | phenylmethanol | WVDDGKGOMKODPV-UHFFFAOYSA-N |
42 | 244.31 | C10H16N2O3S | ![]() |
CID: 253 | 5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-6-yl)pentanoic acid | YBJHBAHKTGYVGT-UHFFFAOYSA-N |
43 | 186.20 | C12H10O2 | ![]() |
CID: 254 | 3-phenylbenzene-1,2-diol | YKOQAAJBYBTSBS-UHFFFAOYSA-N |
44 | 72.105 | C4H8O | ![]() |
CID: 261 | butanal | ZTQSAGDEMFDKMZ-UHFFFAOYSA-N |
45 | 329.20 | C10H12N5O6P | ![]() |
CID: 274 | 8-(6-amino-9-purinyl)-3-hydroxy-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]nonan-9-ol | IVOMOUWHDPKRLL-UHFFFAOYSA-N |
46 | 176.17 | C5H12N4O3 | ![]() |
CID: 275 | 2-amino-4-guanidinooxybutanoic acid | FSBIGDSBMBYOPN-UHFFFAOYSA-N |
47 | 176.12 | C5H8N2O5 | ![]() |
CID: 279 | 2-ureidobutanedioic acid | HLKXYZVTANABHZ-UHFFFAOYSA-N |
48 | 91.066 | C2H5NO3 | ![]() |
CID: 286 | 2-aminooxyacetic acid | NQRKYASMKDDGHT-UHFFFAOYSA-N |
49 | 161.19 | C7H15NO3 | ![]() |
CID: 288 | 3-hydroxy-4-(trimethylammonio)butanoate | PHIQHXFUZVPYII-UHFFFAOYSA-N |
50 | 110.11 | C6H6O2 | ![]() |
CID: 289 | benzene-1,2-diol | YCIMNLLNPGFGHC-UHFFFAOYSA-N |
51 | 345.20 | C10H12N5O7P | ![]() |
CID: 295 | 2-amino-9-(3,9-dihydroxy-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]nonan-8-yl)-3H-purin-6-one | ZOOGRGPOEVQQDX-UHFFFAOYSA-N |
52 | 408.57 | C24H40O5 | ![]() |
CID: 303 | 4-(3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid | BHQCQFFYRZLCQQ-UHFFFAOYSA-N |
53 | 386.65 | C27H46O | ![]() |
CID: 304 | 17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | HVYWMOMLDIMFJA-UHFFFAOYSA-N |
54 | 192.12 | C6H8O7 | ![]() |
CID: 311 | citric acid | KRKNYBCHXYNGOX-UHFFFAOYSA-N |
55 | 323.19 | C9H14N3O8P | ![]() |
CID: 314 | [5-(4-amino-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate | IERHLVCPSMICTF-UHFFFAOYSA-N |
56 | 150.21 | C10H14O | ![]() |
CID: 325 | (4-isopropylphenyl)methanol | OIGWAXDAPKFNCQ-UHFFFAOYSA-N |
57 | 168.14 | C8H8O4 | ![]() |
CID: 328 | 2-hydroxy-2-(4-hydroxyphenyl)acetic acid | YHXHKYRQLYQUIH-UHFFFAOYSA-N |
58 | 108.13 | C7H8O | ![]() |
CID: 335 | 2-methylphenol | QWVGKYWNOKOFNN-UHFFFAOYSA-N |
59 | 138.12 | C7H6O3 | ![]() |
CID: 338 | 2-hydroxybenzoic acid | YGSDEFSMJLZEOE-UHFFFAOYSA-N |
60 | 125.06 | C2H8NO3P | ![]() |
CID: 339 | 2-aminoethylphosphonic acid | QQVDJLLNRSOCEL-UHFFFAOYSA-N |
61 | 124.13 | C7H8O2 | ![]() |
CID: 340 | 3-methylbenzene-1,2-diol | PGSWEKYNAOWQDF-UHFFFAOYSA-N |
62 | 108.13 | C7H8O | ![]() |
CID: 342 | 3-methylphenol | RLSSMJSEOOYNOY-UHFFFAOYSA-N |
63 | 272.25 | C12H16O7 | ![]() |
CID: 346 | 2-(hydroxymethyl)-6-(4-hydroxyphenoxy)tetrahydropyran-3,4,5-triol | BJRNKVDFDLYUGJ-UHFFFAOYSA-N |
64 | 126.11 | C6H6O3 | ![]() |
CID: 359 | benzene-1,3,5-triol | QCDYQQDYXPDABM-UHFFFAOYSA-N |
65 | 170.11 | C7H6O5 | ![]() |
CID: 370 | 3,4,5-trihydroxybenzoic acid | LNTHITQWFMADLM-UHFFFAOYSA-N |
66 | 219.08 | C6H6NO6P | ![]() |
CID: 378 | (4-nitrophenyl) dihydrogen phosphate | XZKIHKMTEMTJQX-UHFFFAOYSA-N |
67 | 144.21 | C8H16O2 | ![]() |
CID: 379 | octanoic acid | WWZKQHOCKIZLMA-UHFFFAOYSA-N |
68 | 160.16 | C7H12O4 | ![]() |
CID: 385 | heptanedioic acid | WLJVNTCWHIRURA-UHFFFAOYSA-N |
69 | 174.19 | C10H10N2O | ![]() |
CID: 397 | 2-(1H-indol-3-yl)acetamide | ZOAMBXDOGPRZLP-UHFFFAOYSA-N |
70 | 102.09 | C3H6N2O2 | ![]() |
CID: 401 | 4-amino-3-isoxazolidinone | DYDCUQKUCUHJBH-UHFFFAOYSA-N |
71 | 109.12 | C6H7NO | ![]() |
CID: 403 | 4-aminophenol | PLIKAWJENQZMHA-UHFFFAOYSA-N |
72 | 148.20 | C9H12N2 | ![]() |
CID: 412 | 3-(2-pyrrolidinyl)pyridine | MYKUKUCHPMASKF-UHFFFAOYSA-N |
73 | 208.34 | C8H16O2S2 | ![]() |
CID: 421 | 6,8-dimercaptooctanoic acid | IZFHEQBZOYJLPK-UHFFFAOYSA-N |
74 | 276.13 | C6H13O10P | ![]() |
CID: 422 | 2,3,4,5-tetrahydroxy-6-phosphonooxyhexanoic acid | BIRSGZKFKXLSJQ-UHFFFAOYSA-N |
75 | 133.10 | C4H7NO4 | ![]() |
CID: 424 | 2-aminobutanedioic acid | CKLJMWTZIZZHCS-UHFFFAOYSA-N |
76 | 256.25 | C15H12O4 | ![]() |
CID: 425 | 1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-2-propen-1-one | DXDRHHKMWQZJHT-UHFFFAOYSA-N |
77 | 74.124 | C3H10N2 | ![]() |
CID: 428 | propane-1,3-diamine | XFNJVJPLKCPIBV-UHFFFAOYSA-N |
78 | 384.63 | C27H44O | ![]() |
CID: 440 | 17-(1,5-dimethylhexyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one | NYOXRYYXRWJDKP-UHFFFAOYSA-N |
79 | 104.10 | C4H8O3 | ![]() |
CID: 441 | 3-hydroxybutanoic acid | WHBMMWSBFZVSSR-UHFFFAOYSA-N |
80 | 128.21 | C8H16O | ![]() |
CID: 454 | octanal | NUJGJRNETVAIRJ-UHFFFAOYSA-N |
81 | 137.15 | C7H9N2O | ![]() |
CID: 457 | 1-methyl-3-pyridin-1-iumcarboxamide | LDHMAVIPBRSVRG-UHFFFAOYSA-O |
82 | 124.13 | C7H8O2 | ![]() |
CID: 460 | 2-methoxyphenol | LHGVFZTZFXWLCP-UHFFFAOYSA-N |
83 | 179.17 | C9H9NO3 | ![]() |
CID: 464 | 2-[[oxo(phenyl)methyl]amino]acetic acid | QIAFMBKCNZACKA-UHFFFAOYSA-N |
84 | 161.15 | C6H11NO4 | ![]() |
CID: 469 | 2-aminohexanedioic acid | OYIFNHCXNCRBQI-UHFFFAOYSA-N |
85 | 118.13 | C4H10N2O2 | ![]() |
CID: 470 | 2,4-diaminobutanoic acid | OGNSCSPNOLGXSM-UHFFFAOYSA-N |
86 | 304.25 | C15H12O7 | ![]() |
CID: 471 | 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-chromanone | CXQWRCVTCMQVQX-UHFFFAOYSA-N |
87 | 118.08 | C4H6O4 | ![]() |
CID: 487 | 2-methylpropanedioic acid | ZIYVHBGGAOATLY-UHFFFAOYSA-N |
88 | 145.15 | C5H11N3O2 | ![]() |
CID: 500 | 4-guanidinobutanoic acid | TUHVEAJXIMEOSA-UHFFFAOYSA-N |
89 | 156.03 | C2H5O6P | ![]() |
CID: 529 | 2-phosphonooxyacetic acid | ASCFNMCAHFUBCO-UHFFFAOYSA-N |
90 | 101.10 | C4H7NO2 | ![]() |
CID: 535 | 1-aminocyclopropanecarboxylic acid | PAJPWUMXBYXFCZ-UHFFFAOYSA-N |
91 | 168.14 | C8H8O4 | ![]() |
CID: 547 | 2-(3,4-dihydroxyphenyl)acetic acid | CFFZDZCDUFSOFZ-UHFFFAOYSA-N |
92 | 168.19 | C12H8O | ![]() |
CID: 568 | dibenzofuran | TXCDCPKCNAJMEE-UHFFFAOYSA-N |
93 | 131.13 | C4H9N3O2 | ![]() |
CID: 586 | 2-[carbamimidoyl(methyl)amino]acetic acid | CVSVTCORWBXHQV-UHFFFAOYSA-N |
94 | 113.11 | C4H7N3O | ![]() |
CID: 588 | 2-amino-3-methyl-4H-imidazol-5-one | DDRJAANPRJIHGJ-UHFFFAOYSA-N |
95 | 121.15 | C3H7NO2S | ![]() |
CID: 594 | 2-amino-3-mercaptopropanoic acid | XUJNEKJLAYXESH-UHFFFAOYSA-N |
96 | 243.21 | C9H13N3O5 | ![]() |
CID: 596 | 4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-2-pyrimidinone | UHDGCWIWMRVCDJ-UHFFFAOYSA-N |
97 | 111.10 | C4H5N3O | ![]() |
CID: 597 | 6-amino-1H-pyrimidin-2-one | OPTASPLRGRRNAP-UHFFFAOYSA-N |
98 | 142.19 | C2H6O3S2 | ![]() |
CID: 598 | 2-mercaptoethanesulfonic acid | ZNEWHQLOPFWXOF-UHFFFAOYSA-N |
99 | 160.17 | C6H12N2O3 | ![]() |
CID: 601 | 2-[(2-amino-1-oxopropyl)amino]propanoic acid | DEFJQIDDEAULHB-UHFFFAOYSA-N |
100 | 89.093 | C3H7NO2 | ![]() |
CID: 602 | 2-aminopropanoic acid | QNAYBMKLOCPYGJ-UHFFFAOYSA-N |
101 | 196.15 | C6H12O7 | ![]() |
CID: 604 | 2,3,4,5,6-pentahydroxyhexanoic acid | RGHNJXZEOKUKBD-UHFFFAOYSA-N |
102 | 210.13 | C6H10O8 | ![]() |
CID: 607 | 2,3,4,5-tetrahydroxyhexanedioic acid | DSLZVSRJTYRBFB-UHFFFAOYSA-N |
103 | 178.13 | C6H10O6 | ![]() |
CID: 608 | 5-(1,2-dihydroxyethyl)-3,4-dihydroxy-2-tetrahydrofuranone | SXZYCXMUPBBULW-UHFFFAOYSA-N |
104 | 147.12 | C5H9NO4 | ![]() |
CID: 611 | 2-aminopentanedioic acid | WHUUTDBJXJRKMK-UHFFFAOYSA-N |
105 | 90.077 | C3H6O3 | ![]() |
CID: 612 | 2-hydroxypropanoic acid | JVTAAEKCZFNVCJ-UHFFFAOYSA-N |
106 | 115.13 | C5H9NO2 | ![]() |
CID: 614 | 2-pyrrolidinecarboxylic acid | ONIBWKKTOPOVIA-UHFFFAOYSA-N |
107 | 105.09 | C3H7NO3 | ![]() |
CID: 617 | 2-amino-3-hydroxypropanoic acid | MTCFGRXMJLQNBG-UHFFFAOYSA-N |
108 | 331.22 | C10H14N5O6P | ![]() |
CID: 621 | [5-(6-amino-9-purinyl)-3-hydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate | KHWCHTKSEGGWEX-UHFFFAOYSA-N |
109 | 251.24 | C10H13N5O3 | ![]() |
CID: 636 | 5-(6-amino-9-purinyl)-2-(hydroxymethyl)-3-tetrahydrofuranol | OLXZPDWKRNYJJZ-UHFFFAOYSA-N |
110 | 227.21 | C9H13N3O4 | ![]() |
CID: 637 | 4-amino-1-[4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-2-pyrimidinone | CKTSBUTUHBMZGZ-UHFFFAOYSA-N |
111 | 267.24 | C10H13N5O4 | ![]() |
CID: 638 | 2-amino-9-[4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-3H-purin-6-one | YKBGVTZYEHREMT-UHFFFAOYSA-N |
112 | 228.20 | C9H12N2O5 | ![]() |
CID: 640 | 1-[4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]pyrimidine-2,4-dione | MXHRCPNRJAMMIM-UHFFFAOYSA-N |
113 | 114.10 | C4H6N2O2 | ![]() |
CID: 649 | hexahydropyrimidine-2,4-dione | OIVLITBTBDPEFK-UHFFFAOYSA-N |
114 | 148.15 | C9H8O2 | ![]() |
CID: 660 | 2-chromanone | VMUXSMXIQBNMGZ-UHFFFAOYSA-N |
115 | 170.05 | C3H7O6P | ![]() |
CID: 668 | (3-hydroxy-2-oxopropyl) dihydrogen phosphate | GNGACRATGGDKBX-UHFFFAOYSA-N |
116 | 90.077 | C3H6O3 | ![]() |
CID: 670 | 1,3-dihydroxy-2-propanone | RXKJFZQQPQGTFL-UHFFFAOYSA-N |
117 | 204.17 | C11H8O4 | ![]() |
CID: 671 | 1,4-dihydroxy-2-naphthalenecarboxylic acid | VOJUXHHACRXLTD-UHFFFAOYSA-N |
118 | 103.11 | C4H9NO2 | ![]() |
CID: 673 | 2-(dimethylamino)acetic acid | FFDGPVCHZBVARC-UHFFFAOYSA-N |
119 | 146.18 | C9H10N2 | ![]() |
CID: 675 | 5,6-dimethyl-1H-benzimidazole | LJUQGASMPRMWIW-UHFFFAOYSA-N |
120 | 153.17 | C8H11NO2 | ![]() |
CID: 681 | 4-(2-aminoethyl)benzene-1,2-diol | VYFYYTLLBUKUHU-UHFFFAOYSA-N |
121 | 200.08 | C4H9O7P | ![]() |
CID: 697 | (2,3-dihydroxy-4-oxobutyl) dihydrogen phosphate | NGHMDNPXVRFFGS-UHFFFAOYSA-N |
122 | 61.083 | C2H7NO | ![]() |
CID: 700 | 2-aminoethanol | HZAXFHJVJLSVMW-UHFFFAOYSA-N |
123 | 186.05 | C3H7O7P | ![]() |
CID: 724 | 2-hydroxy-3-phosphonooxypropanoic acid | OSJPPGNTCRNQQC-UHFFFAOYSA-N |
124 | 170.05 | C3H7O6P | ![]() |
CID: 729 | (2-hydroxy-3-oxopropyl) dihydrogen phosphate | LXJXRIRHZLFYRP-UHFFFAOYSA-N |
125 | 178.13 | C6H10O6 | ![]() |
CID: 736 | 3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranone | PHOQVHQSTUBQQK-UHFFFAOYSA-N |
126 | 146.14 | C5H10N2O3 | ![]() |
CID: 738 | 2,5-diamino-5-oxopentanoic acid | ZDXPYRJPNDTMRX-UHFFFAOYSA-N |
127 | 259.15 | C6H14NO8P | ![]() |
CID: 740 | [3-amino-4,5-dihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl] dihydrogen phosphate | YMJBYRVFGYXULK-UHFFFAOYSA-N |
128 | 132.11 | C5H8O4 | ![]() |
CID: 743 | glutaric acid | JFCQEDHGNNZCLN-UHFFFAOYSA-N |
129 | 75.066 | C2H5NO2 | ![]() |
CID: 750 | 2-aminoacetic acid | DHMQDGOQFOQNFH-UHFFFAOYSA-N |
130 | 90.077 | C3H6O3 | ![]() |
CID: 751 | 2,3-dihydroxypropanal | MNQZXJOMYWMBOU-UHFFFAOYSA-N |
131 | 106.07 | C3H6O4 | ![]() |
CID: 752 | 2,3-dihydroxypropanoic acid | RBNPOMFGQQGHHO-UHFFFAOYSA-N |
132 | 92.093 | C3H8O3 | ![]() |
CID: 753 | glycerol | PEDCQBHIVMGVHV-UHFFFAOYSA-N |
133 | 172.07 | C3H9O6P | ![]() |
CID: 754 | 2,3-dihydroxypropyl dihydrogen phosphate | AWUCVROLDVIAJX-UHFFFAOYSA-N |
134 | 76.051 | C2H4O3 | ![]() |
CID: 757 | 2-hydroxyacetic acid | AEMRFAOFKBGASW-UHFFFAOYSA-N |
135 | 117.10 | C3H7N3O2 | ![]() |
CID: 763 | 2-guanidinoacetic acid | BPMFZUMJYQTVII-UHFFFAOYSA-N |
136 | 151.12 | C5H5N5O | ![]() |
CID: 764 | 2-amino-3,7-dihydropurin-6-one | UYTPUPDQBNUYGX-UHFFFAOYSA-N |
137 | 283.24 | C10H13N5O5 | ![]() |
CID: 765 | 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-3H-purin-6-one | NYHBQMYGNKIUIF-UHFFFAOYSA-N |
138 | 168.14 | C8H8O4 | ![]() |
CID: 780 | 2-(2,5-dihydroxyphenyl)acetic acid | IGMNYECMUMZDDF-UHFFFAOYSA-N |
139 | 110.11 | C6H6O2 | ![]() |
CID: 785 | benzene-1,4-diol | QIGBRXMKCJKVMJ-UHFFFAOYSA-N |
140 | 33.029 | H3NO | ![]() |
CID: 787 | hydroxylamine | AVXURJPOCDRRFD-UHFFFAOYSA-N |
141 | 136.11 | C5H4N4O | ![]() |
CID: 790 | 3,7-dihydropurin-6-one | FDGQSTZJBFJUBT-UHFFFAOYSA-N |
142 | 131.17 | C6H13NO2 | ![]() |
CID: 791 | 2-amino-3-methylpentanoic acid | AGPKZVBTJJNPAG-UHFFFAOYSA-N |
143 | 348.20 | C10H13N4O8P | ![]() |
CID: 797 | [3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)-2-tetrahydrofuranyl]methyl dihydrogen phosphate | GRSZFWQUAKGDAV-UHFFFAOYSA-N |
144 | 175.18 | C10H9NO2 | ![]() |
CID: 802 | 2-(1H-indol-3-yl)acetic acid | SEOVTRFCIGRIMH-UHFFFAOYSA-N |
145 | 203.19 | C11H9NO3 | ![]() |
CID: 803 | 3-(1H-indol-3-yl)-2-oxopropanoic acid | RSTKLPZEZYGQPY-UHFFFAOYSA-N |
146 | 268.22 | C10H12N4O5 | ![]() |
CID: 804 | 9-[3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-3H-purin-6-one | UGQMRVRMYYASKQ-UHFFFAOYSA-N |
147 | 130.09 | C5H6O4 | ![]() |
CID: 811 | 2-methylenebutanedioic acid | LVHBHZANLOWSRM-UHFFFAOYSA-N |
148 | 117.14 | C5H11NO2 | ![]() |
CID: 824 | 2-aminopentanoic acid | SNDPXSYFESPGGJ-UHFFFAOYSA-N |
149 | 152.14 | C5H12O5 | ![]() |
CID: 827 | pentane-1,2,3,4,5-pentol | HEBKCHPVOIAQTA-UHFFFAOYSA-N |
150 | 175.18 | C6H13N3O3 | ![]() |
CID: 833 | 2-amino-5-ureidopentanoic acid | RHGKLRLOHDJJDR-UHFFFAOYSA-N |
151 | 174.10 | C6H6O6 | ![]() |
CID: 835 | 5-(1,2-dihydroxyethyl)tetrahydrofuran-2,3,4-trione | SBJKKFFYIZUCET-UHFFFAOYSA-N |
152 | 197.18 | C9H11NO4 | ![]() |
CID: 836 | 2-amino-3-(3,4-dihydroxyphenyl)propanoic acid | WTDRDQBEARUVNC-UHFFFAOYSA-N |
153 | 183.20 | C9H13NO3 | ![]() |
CID: 838 | 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol | UCTWMZQNUQWSLP-UHFFFAOYSA-N |
154 | 165.21 | C5H11NO3S | ![]() |
CID: 847 | 2-amino-4-methylsulfinylbutanoic acid | QEFRNWWLZKMPFJ-UHFFFAOYSA-N |
155 | 129.15 | C6H11NO2 | ![]() |
CID: 849 | 2-piperidinecarboxylic acid | HXEACLLIILLPRG-UHFFFAOYSA-N |
156 | 131.17 | C6H13NO2 | ![]() |
CID: 857 | 2-amino-4-methylpentanoic acid | ROHFNLRQFUQHCH-UHFFFAOYSA-N |
157 | 205.34 | C8H15NOS2 | ![]() |
CID: 863 | 5-(3-dithiolanyl)pentanamide | FCCDDURTIIUXBY-UHFFFAOYSA-N |
158 | 190.19 | C7H14N2O4 | ![]() |
CID: 865 | 2,6-diaminoheptanedioic acid | GMKMEZVLHJARHF-UHFFFAOYSA-N |
159 | 104.06 | C3H4O4 | ![]() |
CID: 867 | malonic acid | OFOBLEOULBTSOW-UHFFFAOYSA-N |
160 | 166.17 | C9H10O3 | ![]() |
CID: 873 | 3-(2-hydroxyphenyl)propanoic acid | CJBDUOMQLFKVQC-UHFFFAOYSA-N |
161 | 130.09 | C5H6O4 | ![]() |
CID: 874 | 2-methyl-2-butenedioic acid | HNEGQIOMVPPMNR-UHFFFAOYSA-N |
162 | 150.08 | C4H6O6 | ![]() |
CID: 875 | 2,3-dihydroxybutanedioic acid | FEWJPZIEWOKRBE-UHFFFAOYSA-N |
163 | 149.21 | C5H11NO2S | ![]() |
CID: 876 | 2-amino-4-(methylthio)butanoic acid | FFEARJCKVFRZRR-UHFFFAOYSA-N |
164 | 180.15 | C6H12O6 | ![]() |
CID: 892 | cyclohexane-1,2,3,4,5,6-hexol | CDAISMWEOUEBRE-UHFFFAOYSA-N |
165 | 232.27 | C13H16N2O2 | ![]() |
CID: 896 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide | DRLFMBDRBRZALE-UHFFFAOYSA-N |
166 | 221.20 | C8H15NO6 | ![]() |
CID: 899 | N-[2,4,5-trihydroxy-6-(hydroxymethyl)-3-tetrahydropyranyl]acetamide | OVRNDRQMDRJTHS-UHFFFAOYSA-N |
167 | 218.25 | C12H14N2O2 | ![]() |
CID: 903 | N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]acetamide | MVAWJSIDNICKHF-UHFFFAOYSA-N |
168 | 135.16 | C8H9NO | ![]() |
CID: 904 | N-phenylacetamide | FZERHIULMFGESH-UHFFFAOYSA-N |
169 | 174.19 | C7H14N2O3 | ![]() |
CID: 907 | 2-acetamido-5-aminopentanoic acid | JRLGPAXAGHMNOL-UHFFFAOYSA-N |
170 | 177.22 | C6H11NO3S | ![]() |
CID: 911 | 2-formamido-4-(methylthio)butanoic acid | PYUSHNKNPOHWEZ-UHFFFAOYSA-N |
171 | 151.20 | C9H13NO | ![]() |
CID: 913 | 2-(methylamino)-1-phenylethanol | ZCTYHONEGJTYQV-UHFFFAOYSA-N |
172 | 218.25 | C12H14N2O2 | ![]() |
CID: 914 | 3-(1H-indol-3-yl)-2-(methylamino)propanoic acid | CZCIKBSVHDNIDH-UHFFFAOYSA-N |
173 | 128.17 | C10H8 | ![]() |
CID: 931 | naphthalene | UFWIBTONFRDIAS-UHFFFAOYSA-N |
174 | 122.12 | C6H6N2O | ![]() |
CID: 936 | 3-pyridinecarboxamide | DFPAKSUCGFBDDF-UHFFFAOYSA-N |
175 | 123.10 | C6H5NO2 | ![]() |
CID: 938 | 3-pyridinecarboxylic acid | PVNIIMVLHYAWGP-UHFFFAOYSA-N |
176 | 169.17 | C8H11NO3 | ![]() |
CID: 951 | 4-(2-amino-1-hydroxyethyl)benzene-1,2-diol | SFLSHLFXELFNJZ-UHFFFAOYSA-N |
177 | 219.19 | C8H13NO6 | ![]() |
CID: 954 | 2-amino-4-(4-hydroxy-1,4-dioxobutoxy)butanoic acid | GNISQJGXJIDKDJ-UHFFFAOYSA-N |
178 | 130.22 | C8H18O | ![]() |
CID: 957 | 1-octanol | KBPLFHHGFOOTCA-UHFFFAOYSA-N |
179 | 104.06 | C3H4O4 | ![]() |
CID: 964 | 3-hydroxy-2-oxopropanoic acid | HHDDCCUIIUWNGJ-UHFFFAOYSA-N |
180 | 282.46 | C18H34O2 | ![]() |
CID: 965 | 9-octadecenoic acid | ZQPPMHVWECSIRJ-UHFFFAOYSA-N |
181 | 156.09 | C5H4N2O4 | ![]() |
CID: 967 | 2,4-dioxo-1H-pyrimidine-6-carboxylic acid | PXQPEWDEAKTCGB-UHFFFAOYSA-N |
182 | 132.07 | C4H4O5 | ![]() |
CID: 970 | 2-oxobutanedioic acid | KHPXUQMNIQBQEV-UHFFFAOYSA-N |
183 | 90.034 | C2H2O4 | ![]() |
CID: 971 | oxalic acid | MUBZPKHOEPUJKR-UHFFFAOYSA-N |
184 | 89.050 | C2H3NO3 | ![]() |
CID: 974 | oxamic acid | SOWBFZRMHSNYGE-UHFFFAOYSA-N |
185 | 137.13 | C7H7NO2 | ![]() |
CID: 978 | 4-aminobenzoic acid | ALYNCZNDIQEVRV-UHFFFAOYSA-N |
186 | 180.15 | C9H8O4 | ![]() |
CID: 979 | 3-(4-hydroxyphenyl)-2-oxopropanoic acid | KKADPXVIOXHVKN-UHFFFAOYSA-N |
187 | 139.10 | C6H5NO3 | ![]() |
CID: 980 | 4-nitrophenol | BTJIUGUIPKRLHP-UHFFFAOYSA-N |
188 | 256.42 | C16H32O2 | ![]() |
CID: 985 | palmitic acid | IPCSVZSSVZVIGE-UHFFFAOYSA-N |
189 | 150.12 | C5H10O5 | ![]() |
CID: 993 | 5-(hydroxymethyl)tetrahydrofuran-2,3,4-triol | HMFHBZSHGGEWLO-UHFFFAOYSA-N |
190 | 165.18 | C9H11NO2 | ![]() |
CID: 994 | 2-amino-3-phenylpropanoic acid | COLNVLDHVKWLRT-UHFFFAOYSA-N |
191 | 178.22 | C14H10 | ![]() |
CID: 995 | phenanthrene | YNPNZTXNASCQKK-UHFFFAOYSA-N |
192 | 164.15 | C9H8O3 | ![]() |
CID: 997 | 2-oxo-3-phenylpropanoic acid | BTNMPGBKDVTSJY-UHFFFAOYSA-N |
193 | 120.14 | C8H8O | ![]() |
CID: 998 | 2-phenylacetaldehyde | DTUQWGWMVIHBKE-UHFFFAOYSA-N |
194 | 136.14 | C8H8O2 | ![]() |
CID: 999 | 2-phenylacetic acid | WLJVXDMOQOGPHL-UHFFFAOYSA-N |
195 | 137.17 | C8H11NO | ![]() |
CID: 1000 | 2-amino-1-phenylethanol | ULSIYEODSMZIPX-UHFFFAOYSA-N |
196 | 121.17 | C8H11N | ![]() |
CID: 1001 | 2-phenylethanamine | BHHGXPLMPWCGHP-UHFFFAOYSA-N |
197 | 97.995 | H3O4P | ![]() |
CID: 1004 | phosphoric acid | NBIIXXVUZAFLBC-UHFFFAOYSA-N |
198 | 168.04 | C3H5O6P | ![]() |
CID: 1005 | 2-phosphonooxy-2-propenoic acid | DTBNBXWJWCWCIK-UHFFFAOYSA-N |
199 | 141.06 | C2H8NO4P | ![]() |
CID: 1015 | 2-aminoethyl dihydrogen phosphate | SUHOOTKUPISOBE-UHFFFAOYSA-N |
200 | 199.09 | C4H10NO6P | ![]() |
CID: 1016 | 2-amino-3-phosphonooxybutanoic acid | USRGIUJOYOXOQJ-UHFFFAOYSA-N |
201 | 166.13 | C8H6O4 | ![]() |
CID: 1017 | phthalic acid | XNGIFLGASWRNHJ-UHFFFAOYSA-N |
202 | 123.10 | C6H5NO2 | ![]() |
CID: 1018 | 2-pyridinecarboxylic acid | SIOXPEMLGUPBBT-UHFFFAOYSA-N |
203 | 226.22 | C10H14N2O4 | ![]() |
CID: 1021 | 3-[5-(aminomethyl)-4-(carboxymethyl)-1H-pyrrol-3-yl]propanoic acid | QSHWIQZFGQKFMA-UHFFFAOYSA-N |
204 | 177.97 | H4O7P2 | ![]() |
CID: 1023 | phosphono dihydrogen phosphate | XPPKVPWEQAFLFU-UHFFFAOYSA-N |
205 | 88.151 | C4H12N2 | ![]() |
CID: 1045 | butane-1,4-diamine | KIDHWZJUCRJVML-UHFFFAOYSA-N |
206 | 247.14 | C8H10NO6P | ![]() |
CID: 1051 | (4-formyl-5-hydroxy-6-methyl-3-pyridyl)methyl dihydrogen phosphate | NGVDGCNFYWLIFO-UHFFFAOYSA-N |
207 | 169.17 | C8H11NO3 | ![]() |
CID: 1054 | 4,5-bis(hydroxymethyl)-2-methyl-3-pyridinol | LXNHXLLTXMVWPM-UHFFFAOYSA-N |
208 | 126.11 | C6H6O3 | ![]() |
CID: 1057 | benzene-1,2,3-triol | WQGWDDDVZFFDIG-UHFFFAOYSA-N |
209 | 88.062 | C3H4O3 | ![]() |
CID: 1060 | 2-oxopropanoic acid | LCTONWCANYUPML-UHFFFAOYSA-N |
210 | 192.16 | C7H12O6 | ![]() |
CID: 1064 | 1,3,4,5-tetrahydroxycyclohexanecarboxylic acid | AAWZDTNXLSGCEK-UHFFFAOYSA-N |
211 | 167.11 | C7H5NO4 | ![]() |
CID: 1066 | pyridine-2,3-dicarboxylic acid | GJAWHXHKYYXBSV-UHFFFAOYSA-N |
212 | 179.19 | C5H9NO4S | ![]() |
CID: 1080 | 2-amino-3-(carboxymethylthio)propanoic acid | GBFLZEXEOZUWRN-UHFFFAOYSA-N |
213 | 276.28 | C11H20N2O6 | ![]() |
CID: 1087 | 2-[(5-amino-6-hydroxy-6-oxohexyl)amino]pentanedioic acid | ZDGJAHTZVHVLOT-UHFFFAOYSA-N |
214 | 89.093 | C3H7NO2 | ![]() |
CID: 1088 | 2-(methylamino)acetic acid | FSYKKLYZXJSNPZ-UHFFFAOYSA-N |
215 | 174.15 | C7H10O5 | ![]() |
CID: 1094 | 3,4,5-trihydroxy-1-cyclohexenecarboxylic acid | JXOHGGNKMLTUBP-UHFFFAOYSA-N |
216 | 180.15 | C6H12O6 | ![]() |
CID: 1101 | 1,3,4,5,6-pentahydroxy-2-hexanone | BJHIKXHVCXFQLS-UHFFFAOYSA-N |
217 | 145.24 | C7H19N3 | ![]() |
CID: 1102 | N-(3-aminopropyl)butane-1,4-diamine | ATHGHQPFGPMSJY-UHFFFAOYSA-N |
218 | 202.34 | C10H26N4 | ![]() |
CID: 1103 | N,N'-bis(3-aminopropyl)butane-1,4-diamine | PFNFFQXMRSDOHW-UHFFFAOYSA-N |
219 | 410.71 | C30H50 | ![]() |
CID: 1105 | 2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene | YYGNTYWPHWGJRM-UHFFFAOYSA-N |
220 | 118.08 | C4H6O4 | ![]() |
CID: 1110 | succinic acid | KDYFGRWQOYBRFD-UHFFFAOYSA-N |
221 | 102.08 | C4H6O3 | ![]() |
CID: 1112 | 4-oxobutanoic acid | UIUJIQZEACWQSV-UHFFFAOYSA-N |
222 | 98.078 | H2O4S | ![]() |
CID: 1118 | sulfuric acid | QAOWNCQODCNURD-UHFFFAOYSA-N |
223 | 125.14 | C2H7NO3S | ![]() |
CID: 1123 | 2-aminoethanesulfonic acid | XOAAWQZATWQOTB-UHFFFAOYSA-N |
224 | 126.11 | C5H6N2O2 | ![]() |
CID: 1135 | 5-methyl-1H-pyrimidine-2,4-dione | RWQNBRDOKXIBIV-UHFFFAOYSA-N |
225 | 143.20 | C6H9NOS | ![]() |
CID: 1136 | 2-(4-methyl-5-thiazolyl)ethanol | BKAWJIRCKVUVED-UHFFFAOYSA-N |
226 | 204.22 | C11H12N2O2 | ![]() |
CID: 1148 | 2-amino-3-(1H-indol-3-yl)propanoic acid | QIVBCDIJIAJPQS-UHFFFAOYSA-N |
227 | 181.18 | C9H11NO3 | ![]() |
CID: 1153 | 2-amino-3-(4-hydroxyphenyl)propanoic acid | OUYCCCASQSFEME-UHFFFAOYSA-N |
228 | 112.08 | C4H4N2O2 | ![]() |
CID: 1174 | 1H-pyrimidine-2,4-dione | ISAKRJDGNUQOIC-UHFFFAOYSA-N |
229 | 168.11 | C5H4N4O3 | ![]() |
CID: 1175 | 7,9-dihydro-3H-purine-2,6,8-trione | LEHOTFFKMJEONL-UHFFFAOYSA-N |
230 | 60.055 | CH4N2O | ![]() |
CID: 1176 | urea | XSQUKJJJFZCRTK-UHFFFAOYSA-N |
231 | 138.12 | C6H6N2O2 | ![]() |
CID: 1178 | 3-(1H-imidazol-5-yl)-2-propenoic acid | LOIYMIARKYCTBW-UHFFFAOYSA-N |
232 | 117.14 | C5H11NO2 | ![]() |
CID: 1182 | 2-amino-3-methylbutanoic acid | KZSNJWFQEVHDMF-UHFFFAOYSA-N |
233 | 152.14 | C8H8O3 | ![]() |
CID: 1183 | 4-hydroxy-3-methoxybenzaldehyde | MWOOGOJBHIARFG-UHFFFAOYSA-N |
234 | 152.11 | C5H4N4O2 | ![]() |
CID: 1188 | 3,7-dihydropurine-2,6-dione | LRFVTYWOQMYALW-UHFFFAOYSA-N |
235 | 284.22 | C10H12N4O6 | ![]() |
CID: 1189 | 9-[3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-3H-purine-2,6-dione | UBORTCNDUKBEOP-UHFFFAOYSA-N |
236 | 192.12 | C6H8O7 | ![]() |
CID: 1198 | 1-hydroxypropane-1,2,3-tricarboxylic acid | ODBLHEXUDAPZAU-UHFFFAOYSA-N |
237 | 198.17 | C9H10O5 | ![]() |
CID: 1245 | 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetic acid | CGQCWMIAEPEHNQ-UHFFFAOYSA-N |
238 | 152.14 | C8H8O3 | ![]() |
CID: 1292 | 2-hydroxy-2-phenylacetic acid | IWYDHOAUDWTVEP-UHFFFAOYSA-N |
239 | 400.59 | C23H44O5 | ![]() |
CID: 1321 | decanoic acid [1-(hydroxymethyl)-2-(1-oxodecoxy)ethyl] ester | GNSDEDOVXZDMKM-UHFFFAOYSA-N |
240 | 105.13 | C4H11NO2 | ![]() |
CID: 1531 | 2-amino-2-methylpropane-1,3-diol | UXFQFBNBSPQBJW-UHFFFAOYSA-N |
241 | 70.093 | C3H6N2 | ![]() |
CID: 1647 | 3-aminopropanenitrile | AGSPXMVUFBBBMO-UHFFFAOYSA-N |
242 | 162.14 | C6H10O5 | ![]() |
CID: 1662 | 3-hydroxy-3-methylpentanedioic acid | NPOAOTPXWNWTSH-UHFFFAOYSA-N |
243 | 182.17 | C9H10O4 | ![]() |
CID: 1738 | 2-(4-hydroxy-3-methoxyphenyl)acetic acid | QRMZSPFSDQBLIX-UHFFFAOYSA-N |
244 | 191.18 | C10H9NO3 | ![]() |
CID: 1826 | 2-(5-hydroxy-1H-indol-3-yl)acetic acid | DUUGKQCEGZLZNO-UHFFFAOYSA-N |
245 | 190.24 | C11H14N2O | ![]() |
CID: 1833 | 2-(5-methoxy-1H-indol-3-yl)ethanamine | JTEJPPKMYBDEMY-UHFFFAOYSA-N |
246 | 256.25 | C15H12O4 | ![]() |
CID: 1889 | 7-hydroxy-2-(4-hydroxyphenyl)-4-chromanone | FURUXTVZLHCCNA-UHFFFAOYSA-N |
247 | 75.066 | C2H5NO2 | ![]() |
CID: 1990 | ethanehydroxamic acid | RRUDCFGSUDOHDG-UHFFFAOYSA-N |
248 | 173.20 | C8H15NO3 | ![]() |
CID: 1995 | 2-acetamido-4-methylpentanoic acid | WXNXCEHXYPACJF-UHFFFAOYSA-N |
249 | 246.26 | C13H14N2O3 | ![]() |
CID: 2002 | 2-acetamido-3-(1H-indol-3-yl)propanoic acid | DZTHIGRZJZPRDV-UHFFFAOYSA-N |
250 | 265.33 | C12H15N3O2S | ![]() |
CID: 2082 | N-[6-(propylthio)-1H-benzimidazol-2-yl]carbamic acid methyl ester | HXHWSAZORRCQMX-UHFFFAOYSA-N |
251 | 430.70 | C29H50O2 | ![]() |
CID: 2116 | 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-6-chromanol | GVJHHUAWPYXKBD-UHFFFAOYSA-N |
252 | 472.74 | C31H52O3 | ![]() |
CID: 2117 | acetic acid [2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-6-chromanyl] ester | ZAKOWWREFLAJOT-UHFFFAOYSA-N |
253 | 162.23 | C10H14N2 | ![]() |
CID: 2181 | 3-(2-piperidinyl)pyridine | MTXSIJUGVMTTMU-UHFFFAOYSA-N |
254 | 286.40 | C19H26O2 | ![]() |
CID: 2193 | 10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione | AEMFNILZOJDQLW-UHFFFAOYSA-N |
255 | 180.15 | C9H8O4 | ![]() |
CID: 2244 | 2-acetoxybenzoic acid | BSYNRYMUTXBXSQ-UHFFFAOYSA-N |
256 | 188.22 | C9H16O4 | ![]() |
CID: 2266 | nonanedioic acid | BDJRBEYXGGNYIS-UHFFFAOYSA-N |
257 | 121.13 | C7H7NO | ![]() |
CID: 2331 | benzamide | KXDAEFPNCMNJSK-UHFFFAOYSA-N |
258 | 216.18 | C12H8O4 | ![]() |
CID: 2355 | 4-methoxy-7-furo[3,2-g]chromenone | BGEBZHIAGXMEMV-UHFFFAOYSA-N |
259 | 180.15 | C9H8O4 | ![]() |
CID: 2518 | 3-(3,4-dihydroxyphenyl)-2-propenoic acid | QAIPRVGONGVQAS-UHFFFAOYSA-N |
260 | 194.19 | C8H10N4O2 | ![]() |
CID: 2519 | 1,3,7-trimethylpurine-2,6-dione | RYYVLZVUVIJVGH-UHFFFAOYSA-N |
261 | 172.07 | C3H9O6P | ![]() |
CID: 2526 | [2-hydroxy-1-(hydroxymethyl)ethyl] dihydrogen phosphate | DHCLVCXQIBBOPH-UHFFFAOYSA-N |
262 | 242.44 | C16H34O | ![]() |
CID: 2682 | 1-hexadecanol | BXWNKGSJHAJOGX-UHFFFAOYSA-N |
263 | 162.14 | C6H10O5 | ![]() |
CID: 2859 | 7-oxabicyclo[4.1.0]heptane-2,3,4,5-tetrol | ZHMWOVGZCINIHW-UHFFFAOYSA-N |
264 | 108.13 | C7H8O | ![]() |
CID: 2879 | 4-methylphenol | IWDCLRJOBJJRNH-UHFFFAOYSA-N |
265 | 129.15 | C6H11NO2 | ![]() |
CID: 2901 | 1-aminocyclopentanecarboxylic acid | NILQLFBWTXNUOE-UHFFFAOYSA-N |
266 | 172.26 | C10H20O2 | ![]() |
CID: 2969 | decanoic acid | GHVNFZFCNZKVNT-UHFFFAOYSA-N |
267 | 301.50 | C18H39NO2 | ![]() |
CID: 3126 | 2-aminooctadecane-1,3-diol | OTKJDMGTUTTYMP-UHFFFAOYSA-N |
268 | 288.38 | C18H24O3 | ![]() |
CID: 3269 | 13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol | PROQIPRRNZUXQM-UHFFFAOYSA-N |
269 | 138.05 | C3H7O4P | ![]() |
CID: 3417 | (3-methyl-2-oxiranyl)phosphonic acid | YMDXZJFXQJVXBF-UHFFFAOYSA-N |
270 | 154.12 | C7H6O4 | ![]() |
CID: 3469 | 2,5-dihydroxybenzoic acid | WXTMDXOMEHJXQO-UHFFFAOYSA-N |
271 | 100.11 | C5H8O2 | ![]() |
CID: 3485 | pentanedial | SXRSQZLOMIGNAQ-UHFFFAOYSA-N |
272 | 302.27 | C16H14O6 | ![]() |
CID: 3593 | 5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-chromanone | AIONOLUJZLIMTK-UHFFFAOYSA-N |
273 | 76.054 | CH4N2O2 | ![]() |
CID: 3657 | hydroxyurea | VSNHCAURESNICA-UHFFFAOYSA-N |
274 | 289.36 | C17H23NO3 | ![]() |
CID: 3661 | 3-hydroxy-2-phenylpropanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester | RKUNBYITZUJHSG-UHFFFAOYSA-N |
275 | 147.17 | C9H9NO | ![]() |
CID: 3712 | 1H-indol-3-ylmethanol | IVYPNXXAYMYVSP-UHFFFAOYSA-N |
276 | 189.21 | C11H11NO2 | ![]() |
CID: 3744 | 3-(1H-indol-3-yl)propanoic acid | GOLXRNDWAUTYKT-UHFFFAOYSA-N |
277 | 174.15 | C10H6O3 | ![]() |
CID: 3806 | 5-hydroxynaphthalene-1,4-dione | KQPYUDDGWXQXHS-UHFFFAOYSA-N |
278 | 189.16 | C10H7NO3 | ![]() |
CID: 3845 | 4-oxo-1H-quinoline-2-carboxylic acid | HCZHHEIFKROPDY-UHFFFAOYSA-N |
279 | 166.17 | C9H10O3 | ![]() |
CID: 3848 | 2-hydroxy-3-phenylpropanoic acid | VOXXWSYKYCBWHO-UHFFFAOYSA-N |
280 | 169.07 | C3H8NO5P | ![]() |
CID: 3857 | 2-amino-3-phosphonopropanoic acid | LBTABPSJONFLPO-UHFFFAOYSA-N |
281 | 208.21 | C11H12O4 | ![]() |
CID: 3858 | 2-(phenylmethyl)butanedioic acid | GTOFKXZQQDSVFH-UHFFFAOYSA-N |
282 | 344.31 | C12H24O11 | ![]() |
CID: 3871 | 4-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]hexane-1,2,3,5,6-pentol | VQHSOMBJVWLPSR-UHFFFAOYSA-N |
283 | 200.31 | C12H24O2 | ![]() |
CID: 3893 | dodecanoic acid | POULHZVOKOAJMA-UHFFFAOYSA-N |
284 | 280.44 | C18H32O2 | ![]() |
CID: 3931 | octadeca-9,12-dienoic acid | OYHQOLUKZRVURQ-UHFFFAOYSA-N |
285 | 216.18 | C12H8O4 | ![]() |
CID: 4114 | 9-methoxy-7-furo[3,2-g]chromenone | QXKHYNVANLEOEG-UHFFFAOYSA-N |
286 | 103.11 | C4H9NO2 | ![]() |
CID: 4377 | 2-(methylamino)propanoic acid | GDFAOVXKHJXLEI-UHFFFAOYSA-N |
287 | 108.09 | C6H4O2 | ![]() |
CID: 4650 | 1,4-benzoquinone | AZQWKYJCGOJGHM-UHFFFAOYSA-N |
288 | 254.40 | C16H30O2 | ![]() |
CID: 4668 | 9-hexadecenoic acid | SECPZKHBENQXJG-UHFFFAOYSA-N |
289 | 205.25 | C9H19NO4 | ![]() |
CID: 4678 | 2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide | SNPLKNRPJHDVJA-UHFFFAOYSA-N |
290 | 274.26 | C15H14O5 | ![]() |
CID: 4788 | 3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)-1-propanone | VGEREEWJJVICBM-UHFFFAOYSA-N |
291 | 244.24 | C14H12O4 | ![]() |
CID: 4813 | 5-[2-(3,4-dihydroxyphenyl)vinyl]benzene-1,3-diol | CDRPUGZCRXZLFL-UHFFFAOYSA-N |
292 | 285.33 | C17H19NO3 | ![]() |
CID: 4840 | 5-(1,3-benzodioxol-5-yl)-1-(1-piperidyl)-1-penta-2,4-dienone | MXXWOMGUGJBKIW-UHFFFAOYSA-N |
293 | 334.44 | C20H30O4 | ![]() |
CID: 4953 | 7-[2-(3-hydroxyoct-1-enyl)-5-oxo-1-cyclopent-3-enyl]-5-heptenoic acid | MYHXHCUNDDAEOZ-UHFFFAOYSA-N |
294 | 110.11 | C6H6O2 | ![]() |
CID: 5054 | benzene-1,3-diol | GHMLBKRAJCXXBS-UHFFFAOYSA-N |
295 | 228.24 | C14H12O3 | ![]() |
CID: 5056 | 5-[2-(4-hydroxyphenyl)vinyl]benzene-1,3-diol | LUKBXSAWLPMMSZ-UHFFFAOYSA-N |
296 | 183.18 | C7H5NO3S | ![]() |
CID: 5143 | 1,1-dioxo-1,2-benzothiazol-3-one | CVHZOJJKTDOEJC-UHFFFAOYSA-N |
297 | 286.27 | C13H18O7 | ![]() |
CID: 5145 | 2-(hydroxymethyl)-6-[2-(hydroxymethyl)phenoxy]tetrahydropyran-3,4,5-triol | NGFMICBWJRZIBI-UHFFFAOYSA-N |
298 | 124.13 | C7H8O2 | ![]() |
CID: 5146 | 2-(hydroxymethyl)phenol | CQRYARSYNCAZFO-UHFFFAOYSA-N |
299 | 246.30 | C15H18O3 | ![]() |
CID: 5156 | 3,5a,9-trimethyl-3a,4,5,9b-tetrahydro-3H-benzo[g]benzofuran-2,8-dione | XJHDMGJURBVLLE-UHFFFAOYSA-N |
300 | 176.21 | C10H12N2O | ![]() |
CID: 5202 | 3-(2-aminoethyl)-1H-indol-5-ol | QZAYGJVTTNCVMB-UHFFFAOYSA-N |
301 | 284.47 | C18H36O2 | ![]() |
CID: 5281 | stearic acid | QIQXTHQIDYTFRH-UHFFFAOYSA-N |
302 | 288.42 | C19H28O2 | ![]() |
CID: 5408 | 17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one | MUMGGOZAMZWBJJ-UHFFFAOYSA-N |
303 | 149.10 | C4H7NO5 | ![]() |
CID: 5425 | 2-amino-3-hydroxybutanedioic acid | YYLQUHNPNCGKJQ-UHFFFAOYSA-N |
304 | 137.17 | C8H11NO | ![]() |
CID: 5610 | 4-(2-aminoethyl)phenol | DZGWFCGJZKJUFP-UHFFFAOYSA-N |
305 | 89.093 | C3H7NO2 | ![]() |
CID: 5641 | carbamic acid ethyl ester | JOYRKODLDBILNP-UHFFFAOYSA-N |
306 | 205.16 | C10H7NO4 | ![]() |
CID: 5699 | 8-hydroxy-4-oxo-1H-quinoline-2-carboxylic acid | FBZONXHGGPHHIY-UHFFFAOYSA-N |
307 | 346.46 | C21H30O4 | ![]() |
CID: 5753 | (8S,9S,10R,11S,13S,14S,17S)-11-hydroxy-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one | OMFXVFTZEKFJBZ-HJTSIMOOSA-N |
308 | 362.45 | C21H30O5 | ![]() |
CID: 5754 | (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one | JYGXADMDTFJGBT-VWUMJDOOSA-N |
309 | 288.38 | C18H24O3 | ![]() |
CID: 5756 | (8R,9S,13S,14S,16R,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol | PROQIPRRNZUXQM-ZXXIGWHRSA-N |
310 | 272.38 | C18H24O2 | ![]() |
CID: 5757 | (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol | VOXZDWNPVJITMN-ZBRFXRBCSA-N |
311 | 166.20 | C6H6N4S | ![]() |
CID: 5778 | 6-(methylthio)-7H-purine | UIJIQXGRFSPYQW-UHFFFAOYSA-N |
312 | 182.17 | C6H14O6 | ![]() |
CID: 5780 | (2R,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol | FBPFZTCFMRRESA-JGWLITMVSA-N |
313 | 176.12 | C6H8O6 | ![]() |
CID: 5785 | (2R)-2-[(1S)-1,2-dihydroxyethyl]-4,5-dihydroxy-3-furanone | TYQCGQRIZGCHNB-JLAZNSOCSA-N |
314 | 242.22 | C10H14N2O5 | ![]() |
CID: 5789 | 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-5-methylpyrimidine-2,4-dione | IQFYYKKMVGJFEH-XLPZGREQSA-N |
315 | 109.12 | C6H7NO | ![]() |
CID: 5801 | 2-aminophenol | CDAWCLOXVUBKRW-UHFFFAOYSA-N |
316 | 131.12 | C5H9NO3 | ![]() |
CID: 5810 | (2S,4R)-4-hydroxy-2-pyrrolidinecarboxylic acid | PMMYEEVYMWASQN-DMTCNVIQSA-N |
317 | 169.17 | C8H11NO3 | ![]() |
CID: 5814 | 4-[(1S)-2-amino-1-hydroxyethyl]benzene-1,2-diol | SFLSHLFXELFNJZ-MRVPVSSYSA-N |
318 | 183.20 | C9H13NO3 | ![]() |
CID: 5816 | 4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol | UCTWMZQNUQWSLP-VIFPVBQESA-N |
319 | 360.44 | C21H28O5 | ![]() |
CID: 5839 | (8S,9S,10R,11S,13R,14S,17S)-11-hydroxy-17-(2-hydroxy-1-oxoethyl)-10-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-13-carboxaldehyde | PQSUYGKTWSAVDQ-ZVIOFETBSA-N |
320 | 121.15 | C3H7NO2S | ![]() |
CID: 5862 | (2R)-2-amino-3-mercaptopropanoic acid | XUJNEKJLAYXESH-REOHCLBHSA-N |
321 | 270.36 | C18H22O2 | ![]() |
CID: 5870 | (8R,9S,13S,14S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one | DNXHEGUUPJUMQT-CBZIJGRNSA-N |
322 | 290.44 | C19H30O2 | ![]() |
CID: 5879 | (3R,5S,8R,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one | QGXBDMJGAMFCBF-HLUDHZFRSA-N |
323 | 288.42 | C19H28O2 | ![]() |
CID: 5881 | (3S,8R,9S,10R,13S,14S)-3-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one | FMGSKLZLMKYGDP-USOAJAOKSA-N |
324 | 223.26 | C15H13NO | ![]() |
CID: 5897 | N-(9H-fluoren-2-yl)acetamide | CZIHNRWJTSTCEX-UHFFFAOYSA-N |
325 | 89.093 | C3H7NO2 | ![]() |
CID: 5950 | (2S)-2-aminopropanoic acid | QNAYBMKLOCPYGJ-REOHCLBHSA-N |
326 | 105.09 | C3H7NO3 | ![]() |
CID: 5951 | (2S)-2-amino-3-hydroxypropanoic acid | MTCFGRXMJLQNBG-REOHCLBHSA-N |
327 | 190.15 | C9H6N2O3 | ![]() |
CID: 5955 | 4-nitro-1-oxidoquinolin-1-ium | YHQDZJICGQWFHK-UHFFFAOYSA-N |
328 | 133.10 | C4H7NO4 | ![]() |
CID: 5960 | (2S)-2-aminobutanedioic acid | CKLJMWTZIZZHCS-REOHCLBHSA-N |
329 | 146.14 | C5H10N2O3 | ![]() |
CID: 5961 | (2S)-2,5-diamino-5-oxopentanoic acid | ZDXPYRJPNDTMRX-VKHMYHEASA-N |
330 | 146.18 | C6H14N2O2 | ![]() |
CID: 5962 | (2S)-2,6-diaminohexanoic acid | KDXKERNSBIXSRK-YFKPBYRVSA-N |
331 | 180.15 | C6H12O6 | ![]() |
CID: 5984 | (3S,4R,5R)-1,3,4,5,6-pentahydroxy-2-hexanone | BJHIKXHVCXFQLS-UYFOZJQFSA-N |
332 | 342.29 | C12H22O11 | ![]() |
CID: 5988 | (2R,3R,4S,5S,6R)-2-[[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)-2-tetrahydrofuranyl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | CZMRCDWAGMRECN-UGDNZRGBSA-N |
333 | 314.46 | C21H30O2 | ![]() |
CID: 5994 | (8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one | RJKFOVLPORLFTN-LEKSSAKUSA-N |
334 | 386.65 | C27H46O | ![]() |
CID: 5997 | (3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | HVYWMOMLDIMFJA-DPAQBDIFSA-N |
335 | 288.42 | C19H28O2 | ![]() |
CID: 6013 | (8R,9S,10R,13S,14S,17S)-17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one | MUMGGOZAMZWBJJ-DYKIIFRCSA-N |
336 | 268.22 | C10H12N4O5 | ![]() |
CID: 6021 | 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-3H-purin-6-one | UGQMRVRMYYASKQ-KQYNXXCUSA-N |
337 | 244.20 | C9H12N2O6 | ![]() |
CID: 6029 | 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]pyrimidine-2,4-dione | DRTQHJPVMGBUCF-XVFCMESISA-N |
338 | 324.18 | C9H13N2O9P | ![]() |
CID: 6030 | [(2R,3S,4R,5R)-5-(2,4-dioxo-1-pyrimidinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate | DJJCXFVJDGTHFX-XVFCMESISA-N |
339 | 180.15 | C6H12O6 | ![]() |
CID: 6036 | (3R,4S,5R,6R)-6-(hydroxymethyl)tetrahydropyran-2,3,4,5-tetrol | WQZGKKKJIJFFOK-SVZMEOIVSA-N |
340 | 145.15 | C9H7NO | ![]() |
CID: 6038 | 1H-quinolin-2-one | LISFMEBWQUVKPJ-UHFFFAOYSA-N |
341 | 197.18 | C9H11NO4 | ![]() |
CID: 6047 | (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid | WTDRDQBEARUVNC-LURJTMIESA-N |
342 | 225.28 | C14H15N3 | ![]() |
CID: 6053 | N,N-dimethyl-4-phenylazoaniline | JCYPECIVGRXBMO-UHFFFAOYSA-N |
343 | 122.16 | C8H10O | ![]() |
CID: 6054 | 2-phenylethanol | WRMNZCZEMHIOCP-UHFFFAOYSA-N |
344 | 181.18 | C9H11NO3 | ![]() |
CID: 6057 | (2S)-2-amino-3-(4-hydroxyphenyl)propanoic acid | OUYCCCASQSFEME-QMMMGPOBSA-N |
345 | 77.149 | C2H7NS | ![]() |
CID: 6058 | 2-aminoethanethiol | UFULAYFCSOUIOV-UHFFFAOYSA-N |
346 | 211.25 | C11H17NO3 | ![]() |
CID: 6082 | 2-amino-1-(2,5-dimethoxyphenyl)-1-propanol | WJAJPNHVVFWKKL-UHFFFAOYSA-N |
347 | 172.20 | C7H8O3S | ![]() |
CID: 6101 | 4-methylbenzenesulfonic acid | JOXIMZWYDAKGHI-UHFFFAOYSA-N |
348 | 131.17 | C6H13NO2 | ![]() |
CID: 6106 | (2S)-2-amino-4-methylpentanoic acid | ROHFNLRQFUQHCH-YFKPBYRVSA-N |
349 | 206.32 | C8H14O2S2 | ![]() |
CID: 6112 | 5-[(3R)-3-dithiolanyl]pentanoic acid | AGBQKNBQESQNJD-SSDOTTSWSA-N |
350 | 93.126 | C6H7N | ![]() |
CID: 6115 | aniline | PAYRUJLWNCNPSJ-UHFFFAOYSA-N |
351 | 286.40 | C19H26O2 | ![]() |
CID: 6128 | (8R,9S,10R,13S,14S)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione | AEMFNILZOJDQLW-QAGGRKNESA-N |
352 | 323.19 | C9H14N3O8P | ![]() |
CID: 6131 | [(2R,3S,4R,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate | IERHLVCPSMICTF-XVFCMESISA-N |
353 | 149.21 | C5H11NO2S | ![]() |
CID: 6137 | (2S)-2-amino-4-(methylthio)butanoic acid | FFEARJCKVFRZRR-BYPYZUCNSA-N |
354 | 182.17 | C6H14O6 | ![]() |
CID: 6251 | (2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol | FBPFZTCFMRRESA-KVTDHHQDSA-N |
355 | 342.29 | C12H22O11 | ![]() |
CID: 6255 | (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)-3-tetrahydropyranyl]oxy]tetrahydropyran-3,4,5-triol | GUBGYTABKSRVRQ-QUYVBRFLSA-N |
356 | 132.16 | C5H12N2O2 | ![]() |
CID: 6262 | (2S)-2,5-diaminopentanoic acid | AHLPHDHHMVZTML-BYPYZUCNSA-N |
357 | 155.15 | C6H9N3O2 | ![]() |
CID: 6274 | (2S)-2-amino-3-(1H-imidazol-5-yl)propanoic acid | HNDVDQJCIGZPNO-YFKPBYRVSA-N |
358 | 117.14 | C5H11NO2 | ![]() |
CID: 6287 | (2S)-2-amino-3-methylbutanoic acid | KZSNJWFQEVHDMF-BYPYZUCNSA-N |
359 | 119.11 | C4H9NO3 | ![]() |
CID: 6288 | (2S,3R)-2-amino-3-hydroxybutanoic acid | AYFVYJQAPQTCCC-GBXIJSLDSA-N |
360 | 240.21 | C14H8O4 | ![]() |
CID: 6293 | 1,2-dihydroxyanthracene-9,10-dione | RGCKGOZRHPZPFP-UHFFFAOYSA-N |
361 | 204.22 | C11H12N2O2 | ![]() |
CID: 6305 | (2S)-2-amino-3-(1H-indol-3-yl)propanoic acid | QIVBCDIJIAJPQS-VIFPVBQESA-N |
362 | 131.17 | C6H13NO2 | ![]() |
CID: 6306 | (2S,3S)-2-amino-3-methylpentanoic acid | AGPKZVBTJJNPAG-WHFBIAKZSA-N |
363 | 174.20 | C6H14N4O2 | ![]() |
CID: 6322 | (2S)-2-amino-5-guanidinopentanoic acid | ODKSFYDXXFIFQN-BYPYZUCNSA-N |
364 | 192.16 | C7H12O6 | ![]() |
CID: 6508 | (3R,5R)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid | AAWZDTNXLSGCEK-LNVDRNJUSA-N |
365 | 219.23 | C9H17NO5 | ![]() |
CID: 6613 | 3-[[(2R)-2,4-dihydroxy-3,3-dimethyl-1-oxobutyl]amino]propanoic acid | GHOKWGTUZJEAQD-ZETCQYMHSA-N |
366 | 388.66 | C27H48O | ![]() |
CID: 6665 | (3S,5S,8R,9S,10S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol | QYIXCDOBOSTCEI-QCYZZNICSA-N |
367 | 183.16 | C8H9NO4 | ![]() |
CID: 6723 | 3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinecarboxylic acid | HXACOUQIXZGNBF-UHFFFAOYSA-N |
368 | 182.17 | C12H6O2 | ![]() |
CID: 6724 | acenaphthylene-1,2-dione | AFPRJLBZLPBTPZ-UHFFFAOYSA-N |
369 | 132.15 | C9H8O | ![]() |
CID: 6735 | 1-indanone | QNXSIUBBGPHDDE-UHFFFAOYSA-N |
370 | 222.23 | C12H14O4 | ![]() |
CID: 6781 | benzene-1,2-dicarboxylic acid diethyl ester | FLKPEMZONWLCSK-UHFFFAOYSA-N |
371 | 283.24 | C10H13N5O5 | ![]() |
CID: 6802 | 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-3H-purin-6-one | NYHBQMYGNKIUIF-UUOKFMHZSA-N |
372 | 363.22 | C10H14N5O8P | ![]() |
CID: 6804 | [(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate | RQFCJASXJCIDSX-UUOKFMHZSA-N |
373 | 188.17 | C11H8O3 | ![]() |
CID: 6844 | 1-hydroxy-2-naphthalenecarboxylic acid | SJJCQDRGABAVBB-UHFFFAOYSA-N |
374 | 166.21 | C13H10 | ![]() |
CID: 6853 | 9H-fluorene | NIHNNTQXNPWCJQ-UHFFFAOYSA-N |
375 | 167.20 | C12H9N | ![]() |
CID: 6854 | 9H-carbazole | UJOBWOGCFQCDNV-UHFFFAOYSA-N |
376 | 180.15 | C6H12O6 | ![]() |
CID: 6904 | (3S,4R,5S)-1,3,4,5,6-pentahydroxy-2-hexanone | BJHIKXHVCXFQLS-OTWZMJIISA-N |
377 | 152.14 | C5H12O5 | ![]() |
CID: 6912 | (2S,4R)-pentane-1,2,3,4,5-pentol | HEBKCHPVOIAQTA-NGQZWQHPSA-N |
378 | 112.08 | C5H4O3 | ![]() |
CID: 6919 | 2-furancarboxylic acid | SMNDYUVBFMFKNZ-UHFFFAOYSA-N |
379 | 173.19 | C6H7NO3S | ![]() |
CID: 6926 | 2-aminobenzenesulfonic acid | ZMCHBSMFKQYNKA-UHFFFAOYSA-N |
380 | 150.21 | C10H14O | ![]() |
CID: 6989 | 2-isopropyl-5-methylphenol | MGSRCZKZVOBKFT-UHFFFAOYSA-N |
381 | 122.12 | C7H6O2 | ![]() |
CID: 6998 | 2-hydroxybenzaldehyde | SMQUZDBALVYZAC-UHFFFAOYSA-N |
382 | 170.20 | C12H10O | ![]() |
CID: 7017 | 2-phenylphenol | LLEMOWNGBBNAJR-UHFFFAOYSA-N |
383 | 154.20 | C12H10 | ![]() |
CID: 7095 | phenylbenzene | ZUOUZKKEUPVFJK-UHFFFAOYSA-N |
384 | 173.16 | C10H7NO2 | ![]() |
CID: 7124 | 2-quinolinecarboxylic acid | LOAUVZALPPNFOQ-UHFFFAOYSA-N |
385 | 177.15 | C6H11NO5 | ![]() |
CID: 7152 | 2-[carboxymethyl(2-hydroxyethyl)amino]acetic acid | JYXGIOKAKDAARW-UHFFFAOYSA-N |
386 | 167.20 | C9H13NO2 | ![]() |
CID: 7172 | 4-[1-hydroxy-2-(methylamino)ethyl]phenol | YRCWQPVGYLYSOX-UHFFFAOYSA-N |
387 | 135.18 | C7H5NS | ![]() |
CID: 7222 | 1,3-benzothiazole | IOJUPLGTWVMSFF-UHFFFAOYSA-N |
388 | 358.29 | C12H22O12 | ![]() |
CID: 7314 | (2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]hexanoic acid | JYTUSYBCFIZPBE-AMTLMPIISA-N |
389 | 129.11 | C5H7NO3 | ![]() |
CID: 7405 | (2S)-5-oxo-2-pyrrolidinecarboxylic acid | ODHCTXKNWHHXJC-VKHMYHEASA-N |
390 | 120.14 | C8H8O | ![]() |
CID: 7410 | 1-phenylethanone | KWOLFJPFCHCOCG-UHFFFAOYSA-N |
391 | 128.16 | C7H12O2 | ![]() |
CID: 7413 | cyclohexanecarboxylic acid | NZNMSOFKMUBTKW-UHFFFAOYSA-N |
392 | 138.12 | C7H6O3 | ![]() |
CID: 7420 | 3-hydroxybenzoic acid | IJFXRHURBJZNAO-UHFFFAOYSA-N |
393 | 342.29 | C12H22O11 | ![]() |
CID: 7427 | (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]tetrahydropyran-3,4,5-triol | HDTRYLNUVZCQOY-LIZSDCNHSA-N |
394 | 184.14 | C8H8O5 | ![]() |
CID: 7428 | 3,4,5-trihydroxybenzoic acid methyl ester | FBSFWRHWHYMIOG-UHFFFAOYSA-N |
395 | 150.21 | C10H14O | ![]() |
CID: 7439 | 5-isopropenyl-2-methyl-1-cyclohex-2-enone | ULDHMXUKGWMISQ-UHFFFAOYSA-N |
396 | 134.21 | C10H14 | ![]() |
CID: 7463 | 1-isopropyl-4-methylbenzene | HFPZCAJZSCWRBC-UHFFFAOYSA-N |
397 | 136.19 | C8H12N2 | ![]() |
CID: 7472 | N1,N1-dimethylbenzene-1,4-diamine | BZORFPDSXLZWJF-UHFFFAOYSA-N |
398 | 152.14 | C8H8O3 | ![]() |
CID: 7478 | 4-methoxybenzoic acid | ZEYHEAKUIGZSGI-UHFFFAOYSA-N |
399 | 166.13 | C8H6O4 | ![]() |
CID: 7489 | terephthalic acid | KKEYFWRCBNTPAC-UHFFFAOYSA-N |
400 | 107.15 | C7H9N | ![]() |
CID: 7504 | phenylmethanamine | WGQKYBSKWIADBV-UHFFFAOYSA-N |
401 | 107.15 | C7H9N | ![]() |
CID: 7515 | N-methylaniline | AFBPFSWMIHJQDM-UHFFFAOYSA-N |
402 | 179.23 | C6H13NO3S | ![]() |
CID: 7533 | cyclohexylsulfamic acid | HCAJEUSONLESMK-UHFFFAOYSA-N |
403 | 162.18 | C10H10O2 | ![]() |
CID: 7644 | 3-phenyl-2-propenoic acid methyl ester | CCRCUPLGCSFEDV-UHFFFAOYSA-N |
404 | 176.21 | C11H12O2 | ![]() |
CID: 7649 | 3-phenyl-2-propenoic acid ethyl ester | KBEBGUQPQBELIU-UHFFFAOYSA-N |
405 | 135.16 | C8H9NO | ![]() |
CID: 7680 | 2-phenylacetamide | LSBDFXRDZJMBSC-UHFFFAOYSA-N |
406 | 130.22 | C8H18O | ![]() |
CID: 7720 | 2-ethyl-1-hexanol | YIWUKEYIRIRTPP-UHFFFAOYSA-N |
407 | 113.15 | C6H11NO | ![]() |
CID: 7768 | 2-azepanone | JBKVHLHDHHXQEQ-UHFFFAOYSA-N |
408 | 172.26 | C10H20O2 | ![]() |
CID: 7799 | octanoic acid ethyl ester | YYZUSRORWSJGET-UHFFFAOYSA-N |
409 | 228.37 | C14H28O2 | ![]() |
CID: 7800 | dodecanoic acid ethyl ester | MMXKVMNBHPAILY-UHFFFAOYSA-N |
410 | 102.09 | C3H6N2O2 | ![]() |
CID: 7911 | propanediamide | WRIRWRKPLXCTFD-UHFFFAOYSA-N |
411 | 103.08 | C2H5N3O2 | ![]() |
CID: 7913 | carbamoylurea | OHJMTUPIZMNBFR-UHFFFAOYSA-N |
412 | 99.174 | C6H13N | ![]() |
CID: 7965 | cyclohexanamine | PAFZNILMFXTMIY-UHFFFAOYSA-N |
413 | 95.099 | C5H5NO | ![]() |
CID: 7971 | 3-pyridinol | GRFNBEZIAWKNCO-UHFFFAOYSA-N |
414 | 186.29 | C11H22O2 | ![]() |
CID: 8050 | decanoic acid methyl ester | YRHYCMZPEVDGFQ-UHFFFAOYSA-N |
415 | 86.089 | C4H6O2 | ![]() |
CID: 8066 | 2-butyne-1,4-diol | DLDJFQGPPSQZKI-UHFFFAOYSA-N |
416 | 133.18 | C6H15NO2 | ![]() |
CID: 8086 | 1-(2-hydroxypropylamino)-2-propanol | LVTYICIALWPMFW-UHFFFAOYSA-N |
417 | 158.23 | C9H18O2 | ![]() |
CID: 8091 | octanoic acid methyl ester | JGHZJRVDZXSNKQ-UHFFFAOYSA-N |
418 | 130.18 | C7H14O2 | ![]() |
CID: 8094 | heptanoic acid | MNWFXJYAOYHMED-UHFFFAOYSA-N |
419 | 214.34 | C13H26O2 | ![]() |
CID: 8139 | dodecanoic acid methyl ester | UQDUPQYQJKYHQI-UHFFFAOYSA-N |
420 | 158.23 | C9H18O2 | ![]() |
CID: 8158 | nonanoic acid | FBUKVWPVBMHYJY-UHFFFAOYSA-N |
421 | 158.28 | C10H22O | ![]() |
CID: 8174 | 1-decanol | MWKFXSUHUHTGQN-UHFFFAOYSA-N |
422 | 270.45 | C17H34O2 | ![]() |
CID: 8181 | hexadecanoic acid methyl ester | FLIACVVOZYBSBS-UHFFFAOYSA-N |
423 | 186.33 | C12H26O | ![]() |
CID: 8193 | 1-dodecanol | LQZZUXJYWNFBMV-UHFFFAOYSA-N |
424 | 298.50 | C19H38O2 | ![]() |
CID: 8201 | octadecanoic acid methyl ester | HPEUJPJOZXNMSJ-UHFFFAOYSA-N |
425 | 340.58 | C22H44O2 | ![]() |
CID: 8215 | docosanoic acid | UKMSUNONTOPOIO-UHFFFAOYSA-N |
426 | 270.49 | C18H38O | ![]() |
CID: 8221 | 1-octadecanol | GLDOVTGHNKAZLK-UHFFFAOYSA-N |
427 | 282.54 | C20H42 | ![]() |
CID: 8222 | icosane | CBFCDTFDPHXCNY-UHFFFAOYSA-N |
428 | 74.078 | C3H6O2 | ![]() |
CID: 8299 | 1-hydroxy-2-propanone | XLSMFKSTNGKWQX-UHFFFAOYSA-N |
429 | 390.55 | C24H38O4 | ![]() |
CID: 8343 | benzene-1,2-dicarboxylic acid bis(2-ethylhexyl) ester | BJQHLKABXJIVAM-UHFFFAOYSA-N |
430 | 284.78 | C6Cl6 | ![]() |
CID: 8370 | 1,2,3,4,5,6-hexachlorobenzene | CKAPSXZOOQJIBF-UHFFFAOYSA-N |
431 | 136.14 | C8H8O2 | ![]() |
CID: 8375 | 1-(2-hydroxyphenyl)ethanone | JECYUBVRTQDVAT-UHFFFAOYSA-N |
432 | 212.24 | C14H12O2 | ![]() |
CID: 8400 | 2-hydroxy-1,2-di(phenyl)ethanone | ISAOCJYIOMOJEB-UHFFFAOYSA-N |
433 | 150.13 | C8H6O3 | ![]() |
CID: 8406 | 2-formylbenzoic acid | DYNFCHNNOHNJFG-UHFFFAOYSA-N |
434 | 166.17 | C9H10O3 | ![]() |
CID: 8419 | 3,4-dimethoxybenzaldehyde | WJUFSDZVCOTFON-UHFFFAOYSA-N |
435 | 149.21 | C8H7NS | ![]() |
CID: 8446 | 2-methyl-1,3-benzothiazole | DXYYSGDWQCSKKO-UHFFFAOYSA-N |
436 | 168.14 | C8H8O4 | ![]() |
CID: 8468 | 4-hydroxy-3-methoxybenzoic acid | WKOLLVMJNQIZCI-UHFFFAOYSA-N |
437 | 224.21 | C14H8O3 | ![]() |
CID: 8512 | 1-hydroxyanthracene-9,10-dione | BTLXPCBPYBNQNR-UHFFFAOYSA-N |
438 | 348.20 | C10H13N4O8P | ![]() |
CID: 8582 | [(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)-2-tetrahydrofuranyl]methyl dihydrogen phosphate | GRSZFWQUAKGDAV-KQYNXXCUSA-N |
439 | 144.21 | C8H16O2 | ![]() |
CID: 8697 | 2-ethylhexanoic acid | OBETXYAYXDNJHR-UHFFFAOYSA-N |
440 | 174.15 | C7H10O5 | ![]() |
CID: 8742 | (3R,4S,5R)-3,4,5-trihydroxy-1-cyclohexenecarboxylic acid | JXOHGGNKMLTUBP-HSUXUTPPSA-N |
441 | 148.15 | C9H8O2 | ![]() |
CID: 8784 | 3-phenyl-2-propenoic acid | WBYWAXJHAXSJNI-UHFFFAOYSA-N |
442 | 152.23 | C10H16O | ![]() |
CID: 8843 | 3,7-dimethylocta-2,6-dienal | WTEVQBCEXWBHNA-UHFFFAOYSA-N |
443 | 95.099 | C5H5NO | ![]() |
CID: 8871 | 1H-pyridin-2-one | UBQKCCHYAOITMY-UHFFFAOYSA-N |
444 | 116.15 | C6H12O2 | ![]() |
CID: 8892 | hexanoic acid | FUZZWVXGSFPDMH-UHFFFAOYSA-N |
445 | 133.10 | C4H7NO4 | ![]() |
CID: 8897 | 2-(carboxymethylamino)acetic acid | NBZBKCUXIYYUSX-UHFFFAOYSA-N |
446 | 144.25 | C9H20O | ![]() |
CID: 8914 | 1-nonanol | ZWRUINPWMLAQRD-UHFFFAOYSA-N |
447 | 346.46 | C21H30O4 | ![]() |
CID: 9050 | (17R)-17-hydroxy-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one | WHBHBVVOGNECLV-VLAJLFEZSA-N |
448 | 290.26 | C15H14O6 | ![]() |
CID: 9064 | (2R,3S)-2-(3,4-dihydroxyphenyl)chromane-3,5,7-triol | PFTAWBLQPZVEMU-DZGCQCFKSA-N |
449 | 292.45 | C19H32O2 | ![]() |
CID: 9316 | octadeca-9,12,15-trienoic acid methyl ester | DVWSXZIHSUZZKJ-UHFFFAOYSA-N |
450 | 182.17 | C9H10O4 | ![]() |
CID: 9378 | 2-hydroxy-3-(4-hydroxyphenyl)propanoic acid | JVGVDSSUAVXRDY-UHFFFAOYSA-N |
451 | 275.19 | C10H14NO6P | ![]() |
CID: 9395 | phosphoric acid diethyl (4-nitrophenyl) ester | WYMSBXTXOHUIGT-UHFFFAOYSA-N |
452 | 131.17 | C6H13NO2 | ![]() |
CID: 9475 | 2-aminohexanoic acid | LRQKBLKVPFOOQJ-UHFFFAOYSA-N |
453 | 354.30 | C16H18O9 | ![]() |
CID: 9476 | (1S,3R,4R,5R)-3-[3-(3,4-dihydroxyphenyl)-1-oxoallyloxy]-1,4,5-trihydroxycyclohexanecarboxylic acid | CWVRJTMFETXNAD-NCZKRNLISA-N |
454 | 126.11 | C4H6N4O | ![]() |
CID: 9679 | 4-amino-1H-imidazole-5-carboxamide | DVNYTAVYBRSTGK-UHFFFAOYSA-N |
455 | 444.73 | C30H52O2 | ![]() |
CID: 9698 | 2,5,7,8-tetramethyl-2-(5,9,13-trimethyltetradecyl)-6-chromanol | MGVUEHOYGMMEJV-UHFFFAOYSA-N |
456 | 322.20 | C10H15N2O8P | ![]() |
CID: 9700 | [(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-tetrahydrofuranyl]methyl dihydrogen phosphate | GYOZYWVXFNDGLU-XLPZGREQSA-N |
457 | 175.18 | C6H13N3O3 | ![]() |
CID: 9750 | (2S)-2-amino-5-ureidopentanoic acid | RHGKLRLOHDJJDR-BYPYZUCNSA-N |
458 | 300.39 | C19H24O3 | ![]() |
CID: 9791 | 10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17-trione | RZRPTBIGEANTGU-UHFFFAOYSA-N |
459 | 124.13 | C7H8O2 | ![]() |
CID: 9958 | 4-methylbenzene-1,2-diol | ZBCATMYQYDCTIZ-UHFFFAOYSA-N |
460 | 178.18 | C10H10O3 | ![]() |
CID: 9984 | 3-(4-hydroxy-3-methoxyphenyl)-2-propenal | DKZBBWMURDFHNE-UHFFFAOYSA-N |
461 | 88.065 | C2H4N2O2 | ![]() |
CID: 10113 | oxamide | YIKSCQDJHCMVMK-UHFFFAOYSA-N |
462 | 194.22 | C14H10O | ![]() |
CID: 10229 | 9-phenanthrenol | DZKIUEHLEXLYKM-UHFFFAOYSA-N |
463 | 180.20 | C13H8O | ![]() |
CID: 10241 | 9-fluorenone | YLQWCDOCJODRMT-UHFFFAOYSA-N |
464 | 173.16 | C10H7NO2 | ![]() |
CID: 10243 | 4-quinolinecarboxylic acid | VQMSRUREDGBWKT-UHFFFAOYSA-N |
465 | 164.12 | C6H4N4O2 | ![]() |
CID: 10250 | 1H-pteridine-2,4-dione | UYEUUXMDVNYCAM-UHFFFAOYSA-N |
466 | 224.25 | C15H12O2 | ![]() |
CID: 10251 | 2-phenyl-4-chromanone | ZONYXWQDUYMKFB-UHFFFAOYSA-N |
467 | 195.17 | C9H9NO4 | ![]() |
CID: 10253 | 2-[[(2-hydroxyphenyl)-oxomethyl]amino]acetic acid | ONJSZLXSECQROL-UHFFFAOYSA-N |
468 | 167.11 | C7H5NO4 | ![]() |
CID: 10367 | pyridine-2,6-dicarboxylic acid | WJJMNDUMQPNECX-UHFFFAOYSA-N |
469 | 138.16 | C8H10O2 | ![]() |
CID: 10393 | 4-(2-hydroxyethyl)phenol | YCCILVSKPBXVIP-UHFFFAOYSA-N |
470 | 166.17 | C9H10O3 | ![]() |
CID: 10394 | 3-(4-hydroxyphenyl)propanoic acid | NMHMNPHRMNGLLB-UHFFFAOYSA-N |
471 | 130.14 | C6H10O3 | ![]() |
CID: 10428 | 4-hydroxy-4-methyl-2-tetrahydropyranone | JYVXNLLUYHCIIH-UHFFFAOYSA-N |
472 | 112.12 | C6H8O2 | ![]() |
CID: 10434 | cyclohexane-1,3-dione | HJSLFCCWAKVHIW-UHFFFAOYSA-N |
473 | 124.13 | C7H8O2 | ![]() |
CID: 10436 | 5-methylbenzene-1,3-diol | OIPPWFOQEKKFEE-UHFFFAOYSA-N |
474 | 270.45 | C17H34O2 | ![]() |
CID: 10465 | heptadecanoic acid | KEMQGTRYUADPNZ-UHFFFAOYSA-N |
475 | 312.53 | C20H40O2 | ![]() |
CID: 10467 | icosanoic acid | VKOBVWXKNCXXDE-UHFFFAOYSA-N |
476 | 396.68 | C26H52O2 | ![]() |
CID: 10469 | hexacosanoic acid | XMHIUKTWLZUKEX-UHFFFAOYSA-N |
477 | 302.45 | C20H30O2 | ![]() |
CID: 10569 | (1R,4aR,4bR,10aR)-7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid | RSWGJHLUYNHPMX-ONCXSQPRSA-N |
478 | 364.47 | C21H32O5 | ![]() |
CID: 10592 | (17R)-11,17-dihydroxy-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-one | ACSFOIGNUQUIGE-JYJHGPBPSA-N |
479 | 290.44 | C19H30O2 | ![]() |
CID: 10635 | (5S,8R,9S,10S,13S,14S,17S)-17-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one | NVKAWKQGWWIWPM-ABEVXSGRSA-N |
480 | 222.23 | C15H10O2 | ![]() |
CID: 10680 | 2-phenyl-1-benzopyran-4-one | VHBFFQKBGNRLFZ-UHFFFAOYSA-N |
481 | 161.20 | C10H11NO | ![]() |
CID: 10685 | 2-(1H-indol-3-yl)ethanol | MBBOMCVGYCRMEA-UHFFFAOYSA-N |
482 | 196.15 | C6H12O7 | ![]() |
CID: 10690 | (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid | RGHNJXZEOKUKBD-SQOUGZDYSA-N |
483 | 342.29 | C12H22O11 | ![]() |
CID: 10712 | (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)-3-tetrahydropyranyl]oxy]tetrahydropyran-3,4,5-triol | GUBGYTABKSRVRQ-QRZGKKJRSA-N |
484 | 166.17 | C9H10O3 | ![]() |
CID: 10726 | 3-hydroxy-2-phenylpropanoic acid | JACRWUWPXAESPB-UHFFFAOYSA-N |
485 | 179.13 | C6H5N5O2 | ![]() |
CID: 10729 | 2-amino-1,8-dihydropteridine-4,7-dione | GLKCOBIIZKYKFN-UHFFFAOYSA-N |
486 | 198.17 | C9H10O5 | ![]() |
CID: 10742 | 4-hydroxy-3,5-dimethoxybenzoic acid | JMSVCTWVEWCHDZ-UHFFFAOYSA-N |
487 | 133.14 | C8H7NO | ![]() |
CID: 10758 | 2-hydroxy-2-phenylacetonitrile | NNICRUQPODTGRU-UHFFFAOYSA-N |
488 | 126.11 | C6H6O3 | ![]() |
CID: 10787 | benzene-1,2,4-triol | GGNQRNBDZQJCCN-UHFFFAOYSA-N |
489 | 164.20 | C10H12O2 | ![]() |
CID: 10820 | 4-isopropylbenzoic acid | CKMXAIVXVKGGFM-UHFFFAOYSA-N |
490 | 162.20 | C7H16NO3 | ![]() |
CID: 10918 | [(2R)-2,4-dihydroxy-4-oxobutyl]-trimethylammonium | PHIQHXFUZVPYII-ZCFIWIBFSA-O |
491 | 97.072 | C4H3NO2 | ![]() |
CID: 10935 | pyrrole-2,5-dione | PEEHTFAAVSWFBL-UHFFFAOYSA-N |
492 | 228.37 | C14H28O2 | ![]() |
CID: 11005 | tetradecanoic acid | TUNFSRHWOTWDNC-UHFFFAOYSA-N |
493 | 226.44 | C16H34 | ![]() |
CID: 11006 | hexadecane | DCAYPVUWAIABOU-UHFFFAOYSA-N |
494 | 216.25 | C8H12N2O3S | ![]() |
CID: 11082 | (2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid | NGHVIOIJCVXTGV-ALEPSDHESA-N |
495 | 115.08 | C4H5NO3 | ![]() |
CID: 11187 | 4-amino-4-oxo-2-butenoic acid | FSQQTNAZHBEJLS-UHFFFAOYSA-N |
496 | 368.63 | C24H48O2 | ![]() |
CID: 11197 | tetracosanoic acid | QZZGJDVWLFXDLK-UHFFFAOYSA-N |
497 | 104.10 | C4H8O3 | ![]() |
CID: 11266 | 2-hydroxybutanoic acid | AFENDNXGAFYKQO-UHFFFAOYSA-N |
498 | 189.16 | C10H7NO3 | ![]() |
CID: 11321 | 1-acetylindoline-2,3-dione | LPGDEHBASRKTDG-UHFFFAOYSA-N |
499 | 342.29 | C12H22O11 | ![]() |
CID: 11333 | (2S,3R,4S,5R,6R)-2-[[(2R,3S,4S,5R)-4,5-dihydroxy-2,5-bis(hydroxymethyl)-3-tetrahydrofuranyl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | JCQLYHFGKNRPGE-FCVZTGTOSA-N |
500 | 238.23 | C15H10O3 | ![]() |
CID: 11349 | 3-hydroxy-2-phenyl-1-benzopyran-4-one | HVQAJTFOCKOKIN-UHFFFAOYSA-N |
501 | 122.16 | C8H10O | ![]() |
CID: 11476 | (3-methylphenyl)methanol | JJCKHVUTVOPLBV-UHFFFAOYSA-N |
502 | 122.16 | C8H10O | ![]() |
CID: 11505 | (4-methylphenyl)methanol | KMTDMTZBNYGUNX-UHFFFAOYSA-N |
503 | 130.22 | C8H18O | ![]() |
CID: 11527 | 3-octanol | NMRPBPVERJPACX-UHFFFAOYSA-N |
504 | 380.73 | C27H56 | ![]() |
CID: 11636 | heptacosane | BJQWYEJQWHSSCJ-UHFFFAOYSA-N |
505 | 146.14 | C6H10O4 | ![]() |
CID: 11701 | 2,2-dimethylbutanedioic acid | GOHPTLYPQCTZSE-UHFFFAOYSA-N |
506 | 251.90 | C6H4Br2O | ![]() |
CID: 11847 | 2,6-dibromophenol | SSIZLKDLDKIHEV-UHFFFAOYSA-N |
507 | 146.14 | C6H10O4 | ![]() |
CID: 11848 | 2,3-dimethylbutanedioic acid | KLZYRCVPDWTZLH-UHFFFAOYSA-N |
508 | 150.13 | C8H6O3 | ![]() |
CID: 11915 | 2-oxo-2-phenylacetic acid | FAQJJMHZNSSFSM-UHFFFAOYSA-N |
509 | 152.14 | C8H8O3 | ![]() |
CID: 11970 | 2-(2-hydroxyphenyl)acetic acid | CCVYRRGZDBSHFU-UHFFFAOYSA-N |
510 | 132.15 | C9H8O | ![]() |
CID: 11983 | 2-indanone | UMJJFEIKYGFCAT-UHFFFAOYSA-N |
511 | 251.90 | C6H4Br2O | ![]() |
CID: 12005 | 2,4-dibromophenol | FAXWFCTVSHEODL-UHFFFAOYSA-N |
512 | 163.19 | C5H9NO3S | ![]() |
CID: 12035 | (2R)-2-acetamido-3-mercaptopropanoic acid | PWKSKIMOESPYIA-BYPYZUCNSA-N |
513 | 146.14 | C6H10O4 | ![]() |
CID: 12046 | 2-methylpentanedioic acid | AQYCMVICBNBXNA-UHFFFAOYSA-N |
514 | 152.14 | C8H8O3 | ![]() |
CID: 12122 | 2-(3-hydroxyphenyl)acetic acid | FVMDYYGIDFPZAX-UHFFFAOYSA-N |
515 | 146.14 | C6H10O4 | ![]() |
CID: 12284 | 3-methylpentanedioic acid | XJMMNTGIMDZPMU-UHFFFAOYSA-N |
516 | 95.099 | C5H5NO | ![]() |
CID: 12290 | 1H-pyridin-4-one | GCNTZFIIOFTKIY-UHFFFAOYSA-N |
517 | 144.17 | C6H12N2O2 | ![]() |
CID: 12364 | hexanediamide | GVNWZKBFMFUVNX-UHFFFAOYSA-N |
518 | 224.42 | C16H32 | ![]() |
CID: 12395 | 1-hexadecene | GQEZCXVZFLOKMC-UHFFFAOYSA-N |
519 | 466.82 | C31H62O2 | ![]() |
CID: 12400 | triacontanoic acid methyl ester | BIRUBGLRQLAEFF-UHFFFAOYSA-N |
520 | 408.78 | C29H60 | ![]() |
CID: 12409 | nonacosane | IGGUPRCHHJZPBS-UHFFFAOYSA-N |
521 | 111.09 | C5H5NO2 | ![]() |
CID: 12473 | 1H-pyrrole-2-carboxylic acid | WRHZVMBBRYBTKZ-UHFFFAOYSA-N |
522 | 112.12 | C6H8O2 | ![]() |
CID: 12511 | cyclohexane-1,4-dione | DCZFGQYXRKMVFG-UHFFFAOYSA-N |
523 | 338.65 | C24H50 | ![]() |
CID: 12592 | tetracosane | POOSGDOYLQNASK-UHFFFAOYSA-N |
524 | 119.11 | C4H9NO3 | ![]() |
CID: 12647 | (2S)-2-amino-4-hydroxybutanoic acid | UKAUYVFTDYCKQA-VKHMYHEASA-N |
525 | 126.11 | C6H6O3 | ![]() |
CID: 12663 | 2-hydroxy-6-methyl-4-pyranone | OOKCZXGEYPSNIM-UHFFFAOYSA-N |
526 | 99.131 | C5H9NO | ![]() |
CID: 12665 | 2-piperidinone | XUWHAWMETYGRKB-UHFFFAOYSA-N |
527 | 174.09 | C6H7O4P | ![]() |
CID: 12793 | phenyl dihydrogen phosphate | CMPQUABWPXYYSH-UHFFFAOYSA-N |
528 | 112.12 | C6H8O2 | ![]() |
CID: 13006 | cyclohexane-1,2-dione | OILAIQUEIWYQPH-UHFFFAOYSA-N |
529 | 127.18 | C7H13NO | ![]() |
CID: 13017 | N-cyclohexylformamide | SWGXDLRCJNEEGZ-UHFFFAOYSA-N |
530 | 112.02 | CH5O4P | ![]() |
CID: 13130 | methyl dihydrogen phosphate | CAAULPUQFIIOTL-UHFFFAOYSA-N |
531 | 114.10 | C4H6N2O2 | ![]() |
CID: 13538 | 2-amino-3-cyanopropanoic acid | BXRLWGXPSRYJDZ-UHFFFAOYSA-N |
532 | 354.61 | C23H46O2 | ![]() |
CID: 13584 | docosanoic acid methyl ester | QSQLTHHMFHEFIY-UHFFFAOYSA-N |
533 | 116.15 | C6H12O2 | ![]() |
CID: 13601 | cyclohexane-1,2-diol | PFURGBBHAOXLIO-UHFFFAOYSA-N |
534 | 228.20 | C9H12N2O5 | ![]() |
CID: 13712 | 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]pyrimidine-2,4-dione | MXHRCPNRJAMMIM-SHYZEUOFSA-N |
535 | 251.24 | C10H13N5O3 | ![]() |
CID: 13730 | (2R,3S,5R)-5-(6-amino-9-purinyl)-2-(hydroxymethyl)-3-tetrahydrofuranol | OLXZPDWKRNYJJZ-RRKCRQDMSA-N |
536 | 242.39 | C15H30O2 | ![]() |
CID: 13849 | pentadecanoic acid | WQEPLUUGTLDZJY-UHFFFAOYSA-N |
537 | 307.19 | C9H14N3O7P | ![]() |
CID: 13945 | [(2R,3S,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate | NCMVOABPESMRCP-SHYZEUOFSA-N |
538 | 326.55 | C21H42O2 | ![]() |
CID: 14259 | icosanoic acid methyl ester | QGBRLVONZXHAKJ-UHFFFAOYSA-N |
539 | 209.19 | C10H11NO4 | ![]() |
CID: 14349 | 2-[[oxo(phenylmethoxy)methyl]amino]acetic acid | CJUMAFVKTCBCJK-UHFFFAOYSA-N |
540 | 132.15 | C6H12O3 | ![]() |
CID: 14490 | 6-hydroxyhexanoic acid | IWHLYPDWHHPVAA-UHFFFAOYSA-N |
541 | 330.50 | C19H38O4 | ![]() |
CID: 14900 | hexadecanoic acid 2,3-dihydroxypropyl ester | QHZLMUACJMDIAE-UHFFFAOYSA-N |
542 | 172.26 | C10H20O2 | ![]() |
CID: 15606 | nonanoic acid methyl ester | IJXHLVMUNBOGRR-UHFFFAOYSA-N |
543 | 284.47 | C18H36O2 | ![]() |
CID: 15609 | heptadecanoic acid methyl ester | HUEBIMLTDXKIPR-UHFFFAOYSA-N |
544 | 244.37 | C14H28O3 | ![]() |
CID: 16064 | 3-hydroxytetradecanoic acid | ATRNZOYKSNPPBF-UHFFFAOYSA-N |
545 | 197.23 | C8H15N5O | ![]() |
CID: 16553 | 2-(ethylamino)-6-(isopropylamino)-1H-1,3,5-triazin-4-one | NFMIMWNQWAWNDW-UHFFFAOYSA-N |
546 | 164.15 | C6H12O5 | ![]() |
CID: 17106 | (3S,4R,5S,6S)-6-methyltetrahydropyran-2,3,4,5-tetrol | SHZGCJCMOBCMKK-DHVFOXMCSA-N |
547 | 149.21 | C8H7NS | ![]() |
CID: 18170 | thiocyanic acid phenylmethyl ester | ABNDFSOIUFLJAH-UHFFFAOYSA-N |
548 | 145.15 | C6H11NO3 | ![]() |
CID: 18189 | 4-acetamidobutanoic acid | UZTFMUBKZQVKLK-UHFFFAOYSA-N |
549 | 106.12 | C4H10O3 | ![]() |
CID: 18302 | butane-1,2,4-triol | ARXKVVRQIIOZGF-UHFFFAOYSA-N |
550 | 130.14 | C6H10O3 | ![]() |
CID: 18407 | 5-oxohexanoic acid | MGTZCLMLSSAXLD-UHFFFAOYSA-N |
551 | 180.15 | C6H12O6 | ![]() |
CID: 18950 | (3S,4S,5S,6R)-6-(hydroxymethyl)tetrahydropyran-2,3,4,5-tetrol | WQZGKKKJIJFFOK-QTVWNMPRSA-N |
552 | 205.20 | C11H11NO3 | ![]() |
CID: 18986 | 2-(5-methoxy-1H-indol-3-yl)acetic acid | COCNDHOPIHDTHK-UHFFFAOYSA-N |
553 | 154.25 | C4H10O2S2 | ![]() |
CID: 19001 | 1,4-dimercaptobutane-2,3-diol | VHJLVAABSRFDPM-UHFFFAOYSA-N |
554 | 464.63 | C27H44O6 | ![]() |
CID: 19212 | (2S,3R,5R,9R,10R,13R,14S,17R)-17-[(1S,2R)-2,5-dihydroxy-1,5-dimethylhexyl]-2,3,14-trihydroxy-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one | UPEZCKBFRMILAV-JMZLNJERSA-N |
555 | 290.44 | C19H30O2 | ![]() |
CID: 19274 | (3S,8S,9S,10R,13R,14S,16R)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol | CVCDJRPXEWJAAY-UVSUZTNJSA-N |
556 | 182.17 | C9H10O4 | ![]() |
CID: 19844 | 4-hydroxy-3-methoxybenzoic acid methyl ester | BVWTXUYLKBHMOX-UHFFFAOYSA-N |
557 | 278.34 | C16H22O4 | ![]() |
CID: 20393 | 2-[2-ethylhexoxy(oxo)methyl]benzoic acid | DJDSLBVSSOQSLW-UHFFFAOYSA-N |
558 | 131.17 | C6H13NO2 | ![]() |
CID: 21236 | (2S)-2-aminohexanoic acid | LRQKBLKVPFOOQJ-YFKPBYRVSA-N |
559 | 410.71 | C27H54O2 | ![]() |
CID: 22048 | hexacosanoic acid methyl ester | VHUJBYYFFWDLNM-UHFFFAOYSA-N |
560 | 134.17 | C9H10O | ![]() |
CID: 22819 | 1-indanol | YIAPLDFPUUJILH-UHFFFAOYSA-N |
561 | 179.17 | C6H13NO5 | ![]() |
CID: 24154 | (3R,4R,5R,6R)-3-amino-6-(hydroxymethyl)tetrahydropyran-2,4,5-triol | MSWZFWKMSRAUBD-GASJEMHNSA-N |
562 | 358.55 | C21H42O4 | ![]() |
CID: 24699 | octadecanoic acid 2,3-dihydroxypropyl ester | VBICKXHEKHSIBG-UHFFFAOYSA-N |
563 | 180.15 | C6H12O6 | ![]() |
CID: 24749 | 2,3,4,5,6-pentahydroxyhexanal | GZCGUPFRVQAUEE-UHFFFAOYSA-N |
564 | 580.53 | C27H32O14 | ![]() |
CID: 25075 | 7-[[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-2-tetrahydropyranyl]oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4-chromanone | DFPMSGMNTNDNHN-JJLSSNRUSA-N |
565 | 226.18 | C7H14O8 | ![]() |
CID: 25588 | (2R,3R,4S,5R,6R)-2,3,4,5,6,7-hexahydroxyheptanoic acid | KWMLJOLKUYYJFJ-VFUOTHLCSA-N |
566 | 154.24 | C10H18O | ![]() |
CID: 26447 | (2S,5R)-2-isopropyl-5-methylcyclohexanone | NFLGAXVYCFJBMK-BDAKNGLRSA-N |
567 | 478.91 | C34H70 | ![]() |
CID: 26519 | tetratriacontane | GWVDBZWVFGFBCN-UHFFFAOYSA-N |
568 | 133.14 | C8H7NO | ![]() |
CID: 26548 | 2-(4-hydroxyphenyl)acetonitrile | AYKYOOPFBCOXSL-UHFFFAOYSA-N |
569 | 312.53 | C20H40O2 | ![]() |
CID: 26840 | 3,7,11,15-tetramethylhexadecanoic acid | RLCKHJSFHOZMDR-UHFFFAOYSA-N |
570 | 281.26 | C11H15N5O4 | ![]() |
CID: 27476 | (2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-imino-1-methyl-9-purinyl)tetrahydrofuran-3,4-diol | GFYLSDSUCHVORB-IOSLPCCCSA-N |
571 | 111.09 | C5H5NO2 | ![]() |
CID: 28115 | 3-hydroxy-1H-pyridin-2-one | GGOZGYRTNQBSSA-UHFFFAOYSA-N |
572 | 136.23 | C10H16 | ![]() |
CID: 31253 | 7-methyl-3-methyleneocta-1,6-diene | UAHWPYUMFXYFJY-UHFFFAOYSA-N |
573 | 242.39 | C15H30O2 | ![]() |
CID: 31284 | tetradecanoic acid methyl ester | ZAZKJZBWRNNLDS-UHFFFAOYSA-N |
574 | 220.35 | C15H24O | ![]() |
CID: 31404 | 2,6-ditert-butyl-4-methylphenol | NLZUEZXRPGMBCV-UHFFFAOYSA-N |
575 | 138.05 | C3H7O4P | ![]() |
CID: 31669 | [(3S)-3-methyl-2-oxiranyl]phosphonic acid | YMDXZJFXQJVXBF-SCQFTWEKSA-N |
576 | 292.45 | C19H32O2 | ![]() |
CID: 32801 | (8R,9S,10S,13S,14S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol | CBMYJHIOYJEBSB-CAHXEBCQSA-N |
577 | 147.12 | C5H9NO4 | ![]() |
CID: 33032 | (2S)-2-aminopentanedioic acid | WHUUTDBJXJRKMK-VKHMYHEASA-N |
578 | 210.13 | C6H10O8 | ![]() |
CID: 33037 | (2S,3S,4S,5R)-2,3,4,5-tetrahydroxyhexanedioic acid | DSLZVSRJTYRBFB-LLEIAEIESA-N |
579 | 221.20 | C8H15NO6 | ![]() |
CID: 35717 | N-[(3R,4R,5R,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)-3-tetrahydropyranyl]acetamide | OVRNDRQMDRJTHS-KEWYIRBNSA-N |
580 | 167.16 | C8H9NO3 | ![]() |
CID: 36143 | (2S)-2-amino-2-(4-hydroxyphenyl)acetic acid | LJCWONGJFPCTTL-ZETCQYMHSA-N |
581 | 154.24 | C10H18O | ![]() |
CID: 37894 | 2-isopropenyl-2-methylcyclohexanol | WRXDJPNAQJMNGJ-UHFFFAOYSA-N |
582 | 347.22 | C10H14N5O7P | ![]() |
CID: 41211 | [(2R,3S,4R,5R)-5-(6-amino-9-purinyl)-4-hydroxy-2-(hydroxymethyl)-3-tetrahydrofuranyl] dihydrogen phosphate | LNQVTSROQXJCDD-KQYNXXCUSA-N |
583 | 438.76 | C29H58O2 | ![]() |
CID: 41518 | octacosanoic acid methyl ester | ZKHOYAKAFALNQD-UHFFFAOYSA-N |
584 | 166.17 | C6H14O5 | ![]() |
CID: 42953 | 3-(2,3-dihydroxypropoxy)propane-1,2-diol | GPLRAVKSCUXZTP-UHFFFAOYSA-N |
585 | 267.24 | C10H13N5O4 | ![]() |
CID: 60961 | (2R,3R,4S,5R)-2-(6-amino-9-purinyl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol | OIRDTQYFTABQOQ-KQYNXXCUSA-N |
586 | 144.21 | C7H16N2O | ![]() |
CID: 61055 | 3-morpholino-1-propanamine | UIKUBYKUYUSRSM-UHFFFAOYSA-N |
587 | 154.16 | C8H10O3 | ![]() |
CID: 62348 | 4-(hydroxymethyl)-2-methoxyphenol | ZENOXNGFMSCLLL-UHFFFAOYSA-N |
588 | 224.29 | C13H20O3 | ![]() |
CID: 62388 | 2-(3-oxo-2-pent-2-enylcyclopentyl)acetic acid methyl ester | GEWDNTWNSAZUDX-UHFFFAOYSA-N |
589 | 120.14 | C8H8O | ![]() |
CID: 62453 | 4-vinylphenol | FUGYGGDSWSUORM-UHFFFAOYSA-N |
590 | 146.14 | C8H6N2O | ![]() |
CID: 63112 | 1H-quinazolin-4-one | QMNUDYFKZYBWQX-UHFFFAOYSA-N |
591 | 103.11 | C4H9NO2 | ![]() |
CID: 64956 | 3-amino-2-methylpropanoic acid | QCHPKSFMDHPSNR-UHFFFAOYSA-N |
592 | 164.15 | C6H12O5 | ![]() |
CID: 64960 | (2R,3S,4R,5S)-2-(hydroxymethyl)tetrahydropyran-3,4,5-triol | MPCAJMNYNOGXPB-SLPGGIOYSA-N |
593 | 169.18 | C7H11N3O2 | ![]() |
CID: 64969 | (2S)-2-amino-3-(3-methyl-4-imidazolyl)propanoic acid | JDHILDINMRGULE-LURJTMIESA-N |
594 | 458.37 | C22H18O11 | ![]() |
CID: 65064 | 3,4,5-trihydroxybenzoic acid [(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3-chromanyl] ester | WMBWREPUVVBILR-WIYYLYMNSA-N |
595 | 175.13 | C6H9NO5 | ![]() |
CID: 65065 | (2S)-2-acetamidobutanedioic acid | OTCCIMWXFLJLIA-BYPYZUCNSA-N |
596 | 256.25 | C12H16O6 | ![]() |
CID: 65080 | (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(phenoxy)tetrahydropyran-3,4,5-triol | NEZJDVYDSZTRFS-RMPHRYRLSA-N |
597 | 467.15 | C9H16N3O13P3 | ![]() |
CID: 65091 | [(2R,3S,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxy-2-tetrahydrofuranyl]methyl [hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate | RGWHQCVHVJXOKC-SHYZEUOFSA-N |
598 | 133.14 | C5H11NO3 | ![]() |
CID: 65097 | 2-amino-3-hydroxypentanoic acid | LGVJIYCMHMKTPB-UHFFFAOYSA-N |
599 | 117.14 | C5H11NO2 | ![]() |
CID: 65098 | (2S)-2-aminopentanoic acid | SNDPXSYFESPGGJ-BYPYZUCNSA-N |
600 | 178.21 | C5H10N2O3S | ![]() |
CID: 65270 | 2-[(2-amino-3-mercapto-1-oxopropyl)amino]acetic acid | ZUKPVRWZDMRIEO-UHFFFAOYSA-N |
601 | 260.13 | C6H13O9P | ![]() |
CID: 65533 | [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl] dihydrogen phosphate | HXXFSFRBOHSIMQ-VFUOTHLCSA-N |
602 | 302.40 | C19H26O3 | ![]() |
CID: 65542 | (7R,8R,9S,10R,13S,14S)-7-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione | LFWLQMQUJQUZBD-TYHLISGHSA-N |
603 | 150.12 | C5H10O5 | ![]() |
CID: 65550 | (2S,3S,4R)-2,3,4,5-tetrahydroxypentanal | PYMYPHUHKUWMLA-UOWFLXDJSA-N |
604 | 350.49 | C21H34O4 | ![]() |
CID: 65553 | 1-[(3R,5R,8S,9S,10S,11S,13S,14S,17S)-3,11-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-hydroxyethanone | RHQQHZQUAMFINJ-DTDWNVJFSA-N |
605 | 362.45 | C21H30O5 | ![]() |
CID: 65554 | (5R,8S,9S,10S,13S,14S,17R)-17-hydroxy-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,11-dione | YCLWEYIBFOLMEM-FNLRALKVSA-N |
606 | 159.22 | C8H17NO2 | ![]() |
CID: 66085 | 8-aminooctanoic acid | UQXNEWQGGVUVQA-UHFFFAOYSA-N |
607 | 150.12 | C5H10O5 | ![]() |
CID: 66308 | (2S,3R,4R)-2,3,4,5-tetrahydroxypentanal | PYMYPHUHKUWMLA-WDCZJNDASA-N |
608 | 310.35 | C20H14N4 | ![]() |
CID: 66868 | 21,22-dihydroporphyrin | JZRYQZJSTWVBBD-UHFFFAOYSA-N |
609 | 151.16 | C8H9NO2 | ![]() |
CID: 67069 | 2-(methylamino)benzoic acid | WVMBPWMAQDVZCM-UHFFFAOYSA-N |
610 | 240.30 | C6H12N2O4S2 | ![]() |
CID: 67678 | (2R)-2-amino-3-[(2R)-2-amino-3-hydroxy-3-oxopropyl]disulfanylpropanoic acid | LEVWYRKDKASIDU-IMJSIDKUSA-N |
611 | 131.13 | C4H9N3O2 | ![]() |
CID: 67701 | 3-guanidinopropanoic acid | KMXXSJLYVJEBHI-UHFFFAOYSA-N |
612 | 193.19 | C10H11NO3 | ![]() |
CID: 68144 | 2-[(1-oxo-2-phenylethyl)amino]acetic acid | UTYVDVLMYQPLQB-UHFFFAOYSA-N |
613 | 220.35 | C15H24O | ![]() |
CID: 68150 | 3,7,11-trimethyldodeca-2,6,10-trienal | YHRUHBBTQZKMEX-UHFFFAOYSA-N |
614 | 90.077 | C3H6O3 | ![]() |
CID: 68152 | 3-hydroxypropanoic acid | ALRHLSYJTWAHJZ-UHFFFAOYSA-N |
615 | 252.22 | C10H12N4O4 | ![]() |
CID: 68368 | (2R,3S,4R,5R)-2-(hydroxymethyl)-5-(9-purinyl)tetrahydrofuran-3,4-diol | MRWXACSTFXYYMV-FDDDBJFASA-N |
616 | 136.14 | C8H8O2 | ![]() |
CID: 68490 | 2-hydroxy-1-phenylethanone | ZWVHTXAYIKBMEE-UHFFFAOYSA-N |
617 | 180.16 | C8H8N2O3 | ![]() |
CID: 68499 | 2-[[oxo(3-pyridyl)methyl]amino]acetic acid | ZBSGKPYXQINNGF-UHFFFAOYSA-N |
618 | 272.38 | C18H24O2 | ![]() |
CID: 68570 | (8R,9S,13S,14S,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol | VOXZDWNPVJITMN-SFFUCWETSA-N |
619 | 185.07 | C3H8NO6P | ![]() |
CID: 68841 | (2S)-2-amino-3-phosphonooxypropanoic acid | BZQFBWGGLXLEPQ-REOHCLBHSA-N |
620 | 139.10 | C6H5NO3 | ![]() |
CID: 69114 | 2-oxo-1H-pyridine-3-carboxylic acid | UEYQJQVBUVAELZ-UHFFFAOYSA-N |
621 | 145.15 | C9H7NO | ![]() |
CID: 69141 | 1H-quinolin-4-one | PMZDQRJGMBOQBF-UHFFFAOYSA-N |
622 | 114.10 | C4H6N2O2 | ![]() |
CID: 69217 | 1-methylimidazolidine-2,4-dione | RHYBFKMFHLPQPH-UHFFFAOYSA-N |
623 | 89.093 | C3H7NO2 | ![]() |
CID: 69221 | 2-aminoacetic acid methyl ester | KQSSATDQUYCRGS-UHFFFAOYSA-N |
624 | 268.35 | C8H16N2O4S2 | ![]() |
CID: 69382 | (2S)-2-amino-4-(3-amino-4-hydroxy-4-oxobutyl)disulfanylbutanoic acid | ZTVZLYBCZNMWCF-ZBHICJROSA-N |
625 | 260.13 | C6H13O9P | ![]() |
CID: 69507 | [(2R,3R,4S)-2,3,4,6-tetrahydroxy-5-oxohexyl] dihydrogen phosphate | GSXOAOHZAIYLCY-HSUXUTPPSA-N |
626 | 153.18 | C7H11N3O | ![]() |
CID: 69602 | N-[2-(1H-imidazol-5-yl)ethyl]acetamide | XJWPISBUKWZALE-UHFFFAOYSA-N |
627 | 161.15 | C9H7NO2 | ![]() |
CID: 69867 | 1H-indole-3-carboxylic acid | KMAKOBLIOCQGJP-UHFFFAOYSA-N |
628 | 195.21 | C10H13NO3 | ![]() |
CID: 70652 | (2S)-2-amino-3-(4-hydroxyphenyl)propanoic acid methyl ester | MWZPENIJLUWBSY-VIFPVBQESA-N |
629 | 173.20 | C8H15NO3 | ![]() |
CID: 70912 | (2S)-2-acetamido-4-methylpentanoic acid | WXNXCEHXYPACJF-ZETCQYMHSA-N |
630 | 189.16 | C7H11NO5 | ![]() |
CID: 70914 | (2S)-2-acetamidopentanedioic acid | RFMMMVDNIPUKGG-YFKPBYRVSA-N |
631 | 138.12 | C7H6O3 | ![]() |
CID: 70949 | 2,5-dihydroxybenzaldehyde | CLFRCXCBWIQVRN-UHFFFAOYSA-N |
632 | 290.26 | C15H14O6 | ![]() |
CID: 72276 | (2R,3R)-2-(3,4-dihydroxyphenyl)chromane-3,5,7-triol | PFTAWBLQPZVEMU-UKRRQHHQSA-N |
633 | 306.26 | C15H14O7 | ![]() |
CID: 72277 | (2R,3R)-2-(3,4,5-trihydroxyphenyl)chromane-3,5,7-triol | XMOCLSLCDHWDHP-IUODEOHRSA-N |
634 | 169.15 | C3H7NO5S | ![]() |
CID: 72886 | (2R)-2-amino-3-sulfopropanoic acid | XVOYSCVBGLVSOL-REOHCLBHSA-N |
635 | 139.10 | C6H5NO3 | ![]() |
CID: 72924 | 6-oxo-1H-pyridine-3-carboxylic acid | BLHCMGRVFXRYRN-UHFFFAOYSA-N |
636 | 147.12 | C5H9NO4 | ![]() |
CID: 73064 | 3-aminopentanedioic acid | BBJIPMIXTXKYLZ-UHFFFAOYSA-N |
637 | 290.26 | C15H14O6 | ![]() |
CID: 73160 | (2S,3R)-2-(3,4-dihydroxyphenyl)chromane-3,5,7-triol | PFTAWBLQPZVEMU-HIFRSBDPSA-N |
638 | 195.17 | C6H13NO6 | ![]() |
CID: 73563 | (2R,3R,4S,5R)-2-amino-3,4,5,6-tetrahydroxyhexanoic acid | UFYKDFXCZBTLOO-TXICZTDVSA-N |
639 | 188.26 | C10H20O3 | ![]() |
CID: 74300 | 10-hydroxydecanoic acid | YJCJVMMDTBEITC-UHFFFAOYSA-N |
640 | 182.21 | C13H10O | ![]() |
CID: 74318 | 9H-fluoren-9-ol | AFMVESZOYKHDBJ-UHFFFAOYSA-N |
641 | 116.11 | C5H8O3 | ![]() |
CID: 74563 | 2-oxopentanoic acid | KDVFRMMRZOCFLS-UHFFFAOYSA-N |
642 | 207.22 | C11H13NO3 | ![]() |
CID: 74839 | (2S)-2-acetamido-3-phenylpropanoic acid | CBQJSKKFNMDLON-JTQLQIEISA-N |
643 | 265.30 | C14H19NO4 | ![]() |
CID: 74840 | (2S)-4-methyl-2-[[oxo(phenylmethoxy)methyl]amino]pentanoic acid | USPFMEKVPDBMCG-LBPRGKRZSA-N |
644 | 382.66 | C25H50O2 | ![]() |
CID: 75546 | tetracosanoic acid methyl ester | XUDJZDNUVZHSKZ-UHFFFAOYSA-N |
645 | 144.12 | C6H8O4 | ![]() |
CID: 75748 | 2-allylpropanedioic acid | ZDZVKPXKLLLOOA-UHFFFAOYSA-N |
646 | 131.12 | C5H9NO3 | ![]() |
CID: 76406 | 3-acetamidopropanoic acid | LJLLAWRMBZNPMO-UHFFFAOYSA-N |
647 | 195.21 | C10H13NO3 | ![]() |
CID: 76957 | 2-amino-3-(4-hydroxyphenyl)propanoic acid methyl ester | MWZPENIJLUWBSY-UHFFFAOYSA-N |
648 | 230.21 | C13H10O4 | ![]() |
CID: 77093 | phenyl-(2,4,6-trihydroxyphenyl)methanone | CPEXFJVZFNYXGU-UHFFFAOYSA-N |
649 | 174.15 | C9H6N2O2 | ![]() |
CID: 77341 | 4-nitroquinoline | ZPVSFHWMXABGPU-UHFFFAOYSA-N |
650 | 105.20 | C4H11NS | ![]() |
CID: 77743 | 3-(methylthio)-1-propanamine | KKYSBGWCYXYOHA-UHFFFAOYSA-N |
651 | 230.10 | C5H11O8P | ![]() |
CID: 77982 | [(2R,3R,4R)-2,3,4-trihydroxy-5-oxopentyl] dihydrogen phosphate | PPQRONHOSHZGFQ-LMVFSUKVSA-N |
652 | 148.15 | C9H8O2 | ![]() |
CID: 78092 | 3-isochromanone | ILHLUZUMRJQEAH-UHFFFAOYSA-N |
653 | 103.16 | C5H13NO | ![]() |
CID: 79019 | 2-amino-3-methyl-1-butanol | NWYYWIJOWOLJNR-UHFFFAOYSA-N |
654 | 162.14 | C6H10O5 | ![]() |
CID: 79029 | 6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol | TWNIBLMWSKIRAT-UHFFFAOYSA-N |
655 | 172.18 | C7H12N2O3 | ![]() |
CID: 79101 | 1-(2-amino-1-oxoethyl)-2-pyrrolidinecarboxylic acid | KZNQNBZMBZJQJO-UHFFFAOYSA-N |
656 | 342.29 | C12H22O11 | ![]() |
CID: 84571 | (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-[[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)-3-tetrahydropyranyl]oxy]tetrahydropyran-3,4,5-triol | GUBGYTABKSRVRQ-XLOQQCSPSA-N |
657 | 340.11 | C6H14O12P2 | ![]() |
CID: 84951 | [(2R,3R,4S)-2,3,4-trihydroxy-5-oxo-6-phosphonooxyhexyl] dihydrogen phosphate | XPYBSIWDXQFNMH-UYFOZJQFSA-N |
658 | 184.14 | C8H8O5 | ![]() |
CID: 85782 | 2-(3,4-dihydroxyphenyl)-2-hydroxyacetic acid | RGHMISIYKIHAJW-UHFFFAOYSA-N |
659 | 386.65 | C27H46O | ![]() |
CID: 85881 | 17-(1,5-dimethylhexyl)-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one | PESKGJQREUXSRR-UHFFFAOYSA-N |
660 | 390.38 | C17H26O10 | ![]() |
CID: 87691 | (1S,4aS,6S,7R,7aS)-6-hydroxy-7-methyl-1-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid methyl ester | AMBQHHVBBHTQBF-UOUCRYGSSA-N |
661 | 177.15 | C9H7NO3 | ![]() |
CID: 88958 | 5-hydroxy-1H-indole-2-carboxylic acid | BIMHWDJKNOMNLD-UHFFFAOYSA-N |
662 | 156.09 | C5H4N2O4 | ![]() |
CID: 90301 | 2,4-dioxo-1H-pyrimidine-5-carboxylic acid | ZXYAAVBXHKCJJB-UHFFFAOYSA-N |
663 | 302.45 | C20H30O2 | ![]() |
CID: 90895 | 7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid | RSWGJHLUYNHPMX-UHFFFAOYSA-N |
664 | 344.31 | C12H24O11 | ![]() |
CID: 91476 | (2S,3R,4R,5R)-4-[[(2S,3R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]hexane-1,2,3,5,6-pentol | VQHSOMBJVWLPSR-JGMLYOSISA-N |
665 | 384.63 | C27H44O | ![]() |
CID: 91477 | (8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one | NYOXRYYXRWJDKP-GYKMGIIDSA-N |
666 | 276.13 | C6H13O10P | ![]() |
CID: 91493 | (2R,3S,4R,5R)-2,3,4,5-tetrahydroxy-6-phosphonooxyhexanoic acid | BIRSGZKFKXLSJQ-SQOUGZDYSA-N |
667 | 170.16 | C8H10O4 | ![]() |
CID: 91528 | 4-(1,2-dihydroxyethyl)benzene-1,2-diol | MTVWFVDWRVYDOR-UHFFFAOYSA-N |
668 | 180.15 | C6H12O6 | ![]() |
CID: 92092 | (3S,4S,5R)-1,3,4,5,6-pentahydroxy-2-hexanone | BJHIKXHVCXFQLS-PQLUHFTBSA-N |
669 | 386.65 | C27H46O | ![]() |
CID: 92128 | (5S,8R,9S,10S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one | PESKGJQREUXSRR-UXIWKSIVSA-N |
670 | 384.63 | C27H44O | ![]() |
CID: 92746 | (3S,5S,10S,13R,14R,17R)-17-[(1R)-1,5-dimethylhex-4-enyl]-10,13-dimethyl-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | CGSJXLIKVBJVRY-XTGBIJOFSA-N |
671 | 434.39 | C21H22O10 | ![]() |
CID: 92794 | (2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-4-chromanone | DLIKSSGEMUFQOK-SFTVRKLSSA-N |
672 | 342.29 | C12H22O11 | ![]() |
CID: 92797 | (2R,3S,4R,5R)-3,4,5,6-tetrahydroxy-2-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]hexanal | PZDOWFGHCNHPQD-VNNZMYODSA-N |
673 | 342.29 | C12H22O11 | ![]() |
CID: 92807 | (2R,3S,4R,5R)-2,3,4,5-tetrahydroxy-6-[[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]hexanal | AYRXSINWFIIFAE-SCLLYDPQSA-N |
674 | 316.47 | C21H32O2 | ![]() |
CID: 92810 | (5S,8R,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one | XMRPGKVKISIQBV-BJMCWZGWSA-N |
675 | 504.43 | C18H32O16 | ![]() |
CID: 92817 | (2R,3R,4S,5S,6R)-2-[[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-3-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-tetrahydrofuranyl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | QWIZNVHXZXRPDR-WSCXOGSTSA-N |
676 | 134.08 | C4H6O5 | ![]() |
CID: 92824 | (2R)-2-hydroxybutanedioic acid | BJEPYKJPYRNKOW-UWTATZPHSA-N |
677 | 238.23 | C11H14N2O4 | ![]() |
CID: 92829 | (2S)-2-[(2-amino-1-oxoethyl)amino]-3-(4-hydroxyphenyl)propanoic acid | XBGGUPMXALFZOT-VIFPVBQESA-N |
678 | 188.22 | C8H16N2O3 | ![]() |
CID: 92832 | (2S)-6-acetamido-2-aminohexanoic acid | DTERQYGMUDWYAZ-ZETCQYMHSA-N |
679 | 272.42 | C16H32O3 | ![]() |
CID: 92836 | 2-hydroxyhexadecanoic acid | JGHSBPIZNUXPLA-UHFFFAOYSA-N |
680 | 116.15 | C6H12O2 | ![]() |
CID: 92886 | (1R,2R)-cyclohexane-1,2-diol | PFURGBBHAOXLIO-PHDIDXHHSA-N |
681 | 116.15 | C6H12O2 | ![]() |
CID: 92903 | (1R,2S)-cyclohexane-1,2-diol | PFURGBBHAOXLIO-OLQVQODUSA-N |
682 | 205.20 | C11H11NO3 | ![]() |
CID: 92904 | 2-hydroxy-3-(1H-indol-3-yl)propanoic acid | XGILAAMKEQUXLS-UHFFFAOYSA-N |
683 | 188.22 | C8H16N2O3 | ![]() |
CID: 92907 | (2S)-2-acetamido-6-aminohexanoic acid | VEYYWZRYIYDQJM-ZETCQYMHSA-N |
684 | 164.15 | C6H12O5 | ![]() |
CID: 93579 | (2R,3S,4R,5R)-2,3,4,5-tetrahydroxyhexanal | PNNNRSAQSRJVSB-JGWLITMVSA-N |
685 | 302.40 | C19H26O3 | ![]() |
CID: 94141 | (8S,9S,10R,11S,13S,14S)-11-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione | WSCUHXPGYUMQEX-KCZNZURUSA-N |
686 | 152.14 | C5H12O5 | ![]() |
CID: 94154 | (2R,4R)-pentane-1,2,3,4,5-pentol | HEBKCHPVOIAQTA-QWWZWVQMSA-N |
687 | 120.10 | C4H8O4 | ![]() |
CID: 94176 | (2R,3R)-2,3,4-trihydroxybutanal | YTBSYETUWUMLBZ-IUYQGCFVSA-N |
688 | 194.18 | C7H14O6 | ![]() |
CID: 94214 | (2R,3R,4S,5R,6R)-2-(hydroxymethyl)-6-methoxytetrahydropyran-3,4,5-triol | HOVAGTYPODGVJG-VOQCIKJUSA-N |
689 | 89.093 | C3H7NO2 | ![]() |
CID: 94220 | 2-hydroxypropanamide | SXQFCVDSOLSHOQ-UHFFFAOYSA-N |
690 | 300.43 | C20H28O2 | ![]() |
CID: 94391 | (1R,4aS,10aR)-7-isopropyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid | NFWKVWVWBFBAOV-MISYRCLQSA-N |
691 | 194.13 | C6H10O7 | ![]() |
CID: 94715 | (2S,3S,4S,5R)-3,4,5,6-tetrahydroxy-2-tetrahydropyrancarboxylic acid | AEMOLEFTQBMNLQ-AQKNRBDQSA-N |
692 | 180.15 | C6H12O6 | ![]() |
CID: 94780 | (2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexanal | GZCGUPFRVQAUEE-ARQDHWQXSA-N |
693 | 172.18 | C7H12N2O3 | ![]() |
CID: 95514 | 5-(4-hydroxybutyl)imidazolidine-2,4-dione | SQKDMDCPJJTKKB-UHFFFAOYSA-N |
694 | 161.15 | C9H7NO2 | ![]() |
CID: 97250 | 8-hydroxy-1H-quinolin-2-one | ZXZKYYHTWHJHFT-UHFFFAOYSA-N |
695 | 202.20 | C9H14O5 | ![]() |
CID: 97750 | 2-methyl-3-oxobutanedioic acid diethyl ester | OQOCQBJWOCRPQY-UHFFFAOYSA-N |
696 | 175.14 | C5H9N3O4 | ![]() |
CID: 97856 | 2-guanidinobutanedioic acid | VVHOUVWJCQOYGG-UHFFFAOYSA-N |
697 | 118.13 | C5H10O3 | ![]() |
CID: 98009 | 2-hydroxypentanoic acid | JRHWHSJDIILJAT-UHFFFAOYSA-N |
698 | 119.11 | C4H9NO3 | ![]() |
CID: 99289 | (2S,3S)-2-amino-3-hydroxybutanoic acid | AYFVYJQAPQTCCC-HRFVKAFMSA-N |
699 | 180.15 | C6H12O6 | ![]() |
CID: 99459 | (2S,3S,4S,5R)-2,3,4,5,6-pentahydroxyhexanal | GZCGUPFRVQAUEE-KAZBKCHUSA-N |
700 | 119.07 | C3H5NO4 | ![]() |
CID: 100714 | 2-aminopropanedioic acid | JINBYESILADKFW-UHFFFAOYSA-N |
701 | 400.63 | C27H44O2 | ![]() |
CID: 101465 | (2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-3-heptanone | ZJIBAMHOAQWYSE-CNXJXGGASA-N |
702 | 120.10 | C4H8O4 | ![]() |
CID: 101562 | (2S)-tetrahydrofuran-2,3,4-triol | FMAORJIQYMIRHF-LKHOQCSESA-N |
703 | 226.18 | C7H14O8 | ![]() |
CID: 101713 | 2,3,4,5,6,7-hexahydroxyheptanoic acid | KWMLJOLKUYYJFJ-UHFFFAOYSA-N |
704 | 180.15 | C6H12O6 | ![]() |
CID: 102288 | (2R,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexanal | GZCGUPFRVQAUEE-BGPJRJDNSA-N |
705 | 194.13 | C6H10O7 | ![]() |
CID: 102424 | (3S,4R,5S)-3,4,5,6-tetrahydroxy-2-oxohexanoic acid | VBUYCZFBVCCYFD-NUNKFHFFSA-N |
706 | 340.11 | C6H14O12P2 | ![]() |
CID: 105021 | [(2S,3S,4S,5R)-3,4-dihydroxy-2-(hydroxymethyl)-5-(phosphonooxymethyl)-2-tetrahydrofuranyl] dihydrogen phosphate | YXWOAJXNVLXPMU-ZXXMMSQZSA-N |
707 | 111.09 | C5H5NO2 | ![]() |
CID: 105085 | 3-hydroxy-1H-pyridin-4-one | ZCUUVWCJGRQCMZ-UHFFFAOYSA-N |
708 | 144.12 | C6H8O4 | ![]() |
CID: 107550 | 3-hexenedioic acid | YHGNXQAFNHCBTK-UHFFFAOYSA-N |
709 | 90.077 | C3H6O3 | ![]() |
CID: 107689 | (2S)-2-hydroxypropanoic acid | JVTAAEKCZFNVCJ-REOHCLBHSA-N |
710 | 402.65 | C27H46O2 | ![]() |
CID: 107722 | (3S,7S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol | OYXZMSRRJOYLLO-RVOWOUOISA-N |
711 | 109.14 | C2H7NO2S | ![]() |
CID: 107812 | 2-aminoethanesulfinic acid | VVIUBCNYACGLLV-UHFFFAOYSA-N |
712 | 307.42 | C18H29NO3 | ![]() |
CID: 107982 | N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnonanamide | XJQPQKLURWNAAH-UHFFFAOYSA-N |
713 | 183.16 | C8H9NO4 | ![]() |
CID: 108001 | 2-amino-2-(3,5-dihydroxyphenyl)acetic acid | HOOWCUZPEFNHDT-UHFFFAOYSA-N |
714 | 246.26 | C9H18N4O4 | ![]() |
CID: 108172 | (2S)-5-guanidino-2-[[(1R)-2-hydroxy-1-methyl-2-oxoethyl]amino]pentanoic acid | IMXSCCDUAFEIOE-RITPCOANSA-N |
715 | 164.15 | C6H12O5 | ![]() |
CID: 108223 | (3R,4S,5R)-3,4,5,6-tetrahydroxyhexanal | VRYALKFFQXWPIH-PBXRRBTRSA-N |
716 | 215.63 | C9H10ClNO3 | ![]() |
CID: 110992 | (2S)-2-amino-3-(3-chloro-4-hydroxyphenyl)propanoic acid | ACWBBAGYTKWBCD-ZETCQYMHSA-N |
717 | 148.11 | C5H8O5 | ![]() |
CID: 111064 | (3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranone | CUOKHACJLGPRHD-BXXZVTAOSA-N |
718 | 155.19 | C8H13NO2 | ![]() |
CID: 115288 | 2-amino-2-norbornanecarboxylic acid | MPUVBVXDFRDIPT-UHFFFAOYSA-N |
719 | 506.45 | C18H34O16 | ![]() |
CID: 118008 | (2S,3R,5R)-4-[[(2R,3R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-tetrahydropyranyl]oxy]hexane-1,2,3,5,6-pentol | XJCCHWKNFMUJFE-CLYXNOERSA-N |
720 | 162.14 | C6H10O5 | ![]() |
CID: 119054 | (1R,2R,3S,4S,5R,6S)-7-oxabicyclo[4.1.0]heptane-2,3,4,5-tetrol | ZHMWOVGZCINIHW-FTYOSCRSSA-N |
721 | 190.15 | C6H10N2O5 | ![]() |
CID: 121396 | (2S)-2-ureidopentanedioic acid | LCQLHJZYVOQKHU-VKHMYHEASA-N |
722 | 402.65 | C27H46O2 | ![]() |
CID: 121935 | (3S,8S,9S,10R,13S,14S,17S)-17-[(1S)-1-hydroxy-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | MCKLJFJEQRYRQT-APGJSSKUSA-N |
723 | 317.50 | C18H39NO3 | ![]() |
CID: 122121 | (2S,3S,4R)-2-aminooctadecane-1,3,4-triol | AERBNCYCJBRYDG-KSZLIROESA-N |
724 | 464.50 | C24H32O9 | ![]() |
CID: 122281 | (2S,3S,4S,5R,6R)-6-[[(8R,9S,13S,14S,16R,17R)-3,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-16-yl]oxy]-3,4,5-trihydroxy-2-tetrahydropyrancarboxylic acid | FQYGGFDZJFIDPU-JRSYHJKYSA-N |
725 | 422.27 | C12H23O14P | ![]() |
CID: 122336 | [(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-tetrahydropyranyl]methyl dihydrogen phosphate | LABSPYBHMPDTEL-LIZSDCNHSA-N |
726 | 200.08 | C4H9O7P | ![]() |
CID: 122357 | [(2R,3R)-2,3-dihydroxy-4-oxobutyl] dihydrogen phosphate | NGHMDNPXVRFFGS-IUYQGCFVSA-N |
727 | 330.50 | C19H38O4 | ![]() |
CID: 123409 | hexadecanoic acid [2-hydroxy-1-(hydroxymethyl)ethyl] ester | BBNYCLAREVXOSG-UHFFFAOYSA-N |
728 | 337.37 | C15H23N5O4 | ![]() |
CID: 123804 | (2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-5-guanidinopentanoic acid | JXNRXNCCROJZFB-RYUDHWBXSA-N |
729 | 202.25 | C8H18N4O2 | ![]() |
CID: 123831 | (2S)-2-amino-5-[[amino(dimethylamino)methylene]amino]pentanoic acid | YDGMGEXADBMOMJ-LURJTMIESA-N |
730 | 307.32 | C10H17N3O6S | ![]() |
CID: 124886 | (2S)-2-amino-5-[[(1R)-2-(carboxymethylamino)-1-(mercaptomethyl)-2-oxoethyl]amino]-5-oxopentanoic acid | RWSXRVCMGQZWBV-WDSKDSINSA-N |
731 | 196.15 | C6H12O7 | ![]() |
CID: 128869 | (2R,3S,4S,5R)-2,3,4,5,6-pentahydroxyhexanoic acid | RGHNJXZEOKUKBD-MGCNEYSASA-N |
732 | 205.25 | C9H19NO4 | ![]() |
CID: 131204 | (2R)-2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide | SNPLKNRPJHDVJA-ZETCQYMHSA-N |
733 | 212.19 | C10H12O5 | ![]() |
CID: 134310 | 2-[4-(hydroxymethyl)-3-methoxyphenoxy]acetic acid | ZKDXHLFLKKWCBY-UHFFFAOYSA-N |
734 | 115.13 | C5H9NO2 | ![]() |
CID: 145742 | (2S)-2-pyrrolidinecarboxylic acid | ONIBWKKTOPOVIA-BYPYZUCNSA-N |
735 | 147.17 | C9H9NO | ![]() |
CID: 150923 | 3-methyl-2-indolinone | BBZCPUCZKLTAJQ-UHFFFAOYSA-N |
736 | 120.10 | C4H8O4 | ![]() |
CID: 150929 | 3,4-dihydroxybutanoic acid | DZAIOXUZHHTJKN-UHFFFAOYSA-N |
737 | 144.16 | C7H12O3 | ![]() |
CID: 151138 | 4-hydroxycyclohexanecarboxylic acid | HCFRWBBJISAZNK-UHFFFAOYSA-N |
738 | 136.10 | C4H8O5 | ![]() |
CID: 151152 | (2S,3R)-2,3,4-trihydroxybutanoic acid | JPIJQSOTBSSVTP-GBXIJSLDSA-N |
739 | 155.15 | C6H9N3O2 | ![]() |
CID: 151491 | (2S)-2-amino-3-(1-pyrazolyl)propanoic acid | PIGOPELHGLPKLL-YFKPBYRVSA-N |
740 | 194.13 | C6H10O7 | ![]() |
CID: 152867 | 2,3,4,5-tetrahydroxy-6-oxohexanoic acid | IAJILQKETJEXLJ-UHFFFAOYSA-N |
741 | 289.36 | C17H23NO3 | ![]() |
CID: 154417 | (2S)-3-hydroxy-2-phenylpropanoic acid [(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] ester | RKUNBYITZUJHSG-VFSICIBPSA-N |
742 | 270.23 | C11H14N2O6 | ![]() |
CID: 156807 | (2R,3R,4R)-5-(4-nitrophenyl)iminopentane-1,2,3,4-tetrol | KGZKBJWBUXFFPS-GMTAPVOTSA-N |
743 | 165.21 | C5H11NO3S | ![]() |
CID: 158980 | (2S)-2-amino-4-methylsulfinylbutanoic acid | QEFRNWWLZKMPFJ-YGVKFDHGSA-N |
744 | 189.27 | C9H21N2O2 | ![]() |
CID: 159660 | (5-amino-6-hydroxy-6-oxohexyl)-trimethylammonium | MXNRLFUSFKVQSK-UHFFFAOYSA-O |
745 | 130.14 | C6H10O3 | ![]() |
CID: 159664 | 2-oxohexanoic acid | XNIHZNNZJHYHLC-UHFFFAOYSA-N |
746 | 194.13 | C6H10O7 | ![]() |
CID: 159793 | (3R,4S,5R)-3,4,5,6-tetrahydroxy-2-oxohexanoic acid | VBUYCZFBVCCYFD-FLRLBIABSA-N |
747 | 196.20 | C9H12N2O3 | ![]() |
CID: 160450 | (2S)-2-amino-3-(3-amino-4-hydroxyphenyl)propanoic acid | POGSZHUEECCEAP-ZETCQYMHSA-N |
748 | 344.31 | C12H24O11 | ![]() |
CID: 160514 | (2S,3R,4R,5R)-4-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]hexane-1,2,3,5,6-pentol | VQHSOMBJVWLPSR-WELRSGGNSA-N |
749 | 420.66 | C27H48O3 | ![]() |
CID: 160520 | (3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol | RIVQQZVHIVNQFH-XJZYBRFWSA-N |
750 | 208.21 | C10H12N2O3 | ![]() |
CID: 161166 | (2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid | YGPSJZOEDVAXAB-QMMMGPOBSA-N |
751 | 342.29 | C12H22O11 | ![]() |
CID: 165577 | (3S,4S,5R)-1,3,4,6-tetrahydroxy-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-hexanone | DXALOGXSFLZLLN-WTZPKTTFSA-N |
752 | 149.14 | C8H7NO2 | ![]() |
CID: 166768 | 2-hydroxy-2-(4-hydroxyphenyl)acetonitrile | HOOOPXDSCKBLFG-UHFFFAOYSA-N |
753 | 122.11 | C4H10O4 | ![]() |
CID: 169019 | (2R,3R)-butane-1,2,3,4-tetrol | UNXHWFMMPAWVPI-QWWZWVQMSA-N |
754 | 264.27 | C13H16N2O4 | ![]() |
CID: 171161 | N-[3-(2-formamido-5-methoxyphenyl)-3-oxopropyl]acetamide | JYWNYMJKURVPFH-UHFFFAOYSA-N |
755 | 244.31 | C10H16N2O3S | ![]() |
CID: 171548 | 5-[(3aR,6S,6aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-6-yl]pentanoic acid | YBJHBAHKTGYVGT-ZKWXMUAHSA-N |
756 | 169.07 | C3H8NO5P | ![]() |
CID: 177120 | (2R)-2-amino-3-phosphonopropanoic acid | LBTABPSJONFLPO-REOHCLBHSA-N |
757 | 267.24 | C10H13N5O4 | ![]() |
CID: 187790 | 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-3H-purin-6-one | YKBGVTZYEHREMT-KVQBGUIXSA-N |
758 | 504.43 | C18H32O16 | ![]() |
CID: 192826 | (2R,3R,4S,5S,6R)-2-[[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)-3-tetrahydropyranyl]oxy]-3-tetrahydropyranyl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | FYGDTMLNYKFZSV-PXXRMHSHSA-N |
759 | 179.19 | C5H9NO4S | ![]() |
CID: 193653 | (2R)-2-amino-3-(carboxymethylthio)propanoic acid | GBFLZEXEOZUWRN-VKHMYHEASA-N |
760 | 309.31 | C14H19N3O5 | ![]() |
CID: 194988 | (2S)-2-[[(2S)-2-[(2-amino-1-oxoethyl)amino]-3-(4-hydroxyphenyl)-1-oxopropyl]amino]propanoic acid | UIQGJYUEQDOODF-KWQFWETISA-N |
761 | 458.37 | C22H18O11 | ![]() |
CID: 199472 | 3,4,5-trihydroxybenzoic acid [(2S,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3-chromanyl] ester | WMBWREPUVVBILR-NQIIRXRSSA-N |
762 | 210.18 | C7H14O7 | ![]() |
CID: 219662 | 2,3,4,5,6,7-hexahydroxyheptanal | YPZMPEPLWKRVLD-UHFFFAOYSA-N |
763 | 164.15 | C6H12O5 | ![]() |
CID: 220001 | 2,3,4,5-tetrahydroxyhexanal | PNNNRSAQSRJVSB-UHFFFAOYSA-N |
764 | 246.30 | C15H18O3 | ![]() |
CID: 221071 | (3S,3aS,5aS,9bS)-3,5a,9-trimethyl-3a,4,5,9b-tetrahydro-3H-benzo[g]benzofuran-2,8-dione | XJHDMGJURBVLLE-BOCCBSBMSA-N |
765 | 408.57 | C24H40O5 | ![]() |
CID: 221493 | (4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid | BHQCQFFYRZLCQQ-OELDTZBJSA-N |
766 | 134.08 | C4H6O5 | ![]() |
CID: 222656 | (2S)-2-hydroxybutanedioic acid | BJEPYKJPYRNKOW-REOHCLBHSA-N |
767 | 360.44 | C21H28O5 | ![]() |
CID: 222786 | (8S,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11-dione | MFYSYFVPBJMHGN-ZPOLXVRWSA-N |
768 | 133.14 | C5H11NO3 | ![]() |
CID: 222906 | 2-amino-3-methoxybutanoic acid | FYCWLJLGIAUCCL-UHFFFAOYSA-N |
769 | 300.39 | C19H24O3 | ![]() |
CID: 223997 | (8S,9S,10R,13S,14S)-10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17-trione | RZRPTBIGEANTGU-IRIMSJTPSA-N |
770 | 164.15 | C6H12O5 | ![]() |
CID: 225612 | 3,4,5,6-tetrahydroxyhexanal | VRYALKFFQXWPIH-UHFFFAOYSA-N |
771 | 318.49 | C21H34O2 | ![]() |
CID: 228491 | 1-[(3S,5R,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone | AURFZBICLPNKBZ-GRWISUQFSA-N |
772 | 610.56 | C28H34O15 | ![]() |
CID: 232990 | 7-[[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl)oxy]-2-tetrahydropyranyl]oxy]-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-chromanone | ARGKVCXINMKCAZ-UHFFFAOYSA-N |
773 | 126.11 | C6H6O3 | ![]() |
CID: 237332 | 5-(hydroxymethyl)-2-furancarboxaldehyde | NOEGNKMFWQHSLB-UHFFFAOYSA-N |
774 | 292.45 | C19H32O2 | ![]() |
CID: 242332 | (3S,5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol | CBMYJHIOYJEBSB-YSZCXEEOSA-N |
775 | 426.71 | C30H50O | ![]() |
CID: 246983 | (3S,5R,10S,13R,14R,17R)-17-[(1R)-1,5-dimethylhex-4-enyl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol | CAHGCLMLTWQZNJ-BQNIITSRSA-N |
776 | 302.40 | C19H26O3 | ![]() |
CID: 252379 | (8R,9S,10S,13S,14S)-10-(hydroxymethyl)-13-methyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione | XGUHPTGEXRHMQQ-BGJMDTOESA-N |
777 | 167.16 | C8H9NO3 | ![]() |
CID: 255720 | 2-amino-3-methoxybenzoic acid | SXOPCLUOUFQBJV-UHFFFAOYSA-N |
778 | 148.15 | C6H12O4 | ![]() |
CID: 258531 | 3,4,5-trihydroxyhexanal | JWFRNGYBHLBCMB-UHFFFAOYSA-N |
779 | 161.15 | C6H11NO4 | ![]() |
CID: 268779 | 2-(methylamino)pentanedioic acid | XLBVNMSMFQMKEY-UHFFFAOYSA-N |
780 | 197.19 | C8H11N3O3 | ![]() |
CID: 273260 | 2-acetamido-3-(1H-imidazol-5-yl)propanoic acid | KBOJOGQFRVVWBH-UHFFFAOYSA-N |
781 | 103.11 | C4H9NO2 | ![]() |
CID: 316542 | 2-(ethylamino)acetic acid | YPIGGYHFMKJNKV-UHFFFAOYSA-N |
782 | 156.18 | C10H8N2 | ![]() |
CID: 351795 | 2-(1H-indol-3-yl)acetonitrile | DMCPFOBLJMLSNX-UHFFFAOYSA-N |
783 | 152.23 | C10H16O | ![]() |
CID: 369312 | [(4S)-4-isopropenyl-1-cyclohexenyl]methanol | NDTYTMIUWGWIMO-SNVBAGLBSA-N |
784 | 172.07 | C3H9O6P | ![]() |
CID: 439162 | [(2R)-2,3-dihydroxypropyl] dihydrogen phosphate | AWUCVROLDVIAJX-GSVOUGTGSA-N |
785 | 230.10 | C5H11O8P | ![]() |
CID: 439167 | [(2R,3S,4R)-3,4,5-trihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate | KTVPXOYAKDPRHY-SOOFDHNKSA-N |
786 | 297.33 | C11H15N5O3S | ![]() |
CID: 439176 | (2R,3R,4S,5S)-2-(6-amino-9-purinyl)-5-[(methylthio)methyl]tetrahydrofuran-3,4-diol | WUUGFSXJNOTRMR-IOSLPCCCSA-N |
787 | 186.05 | C3H7O7P | ![]() |
CID: 439183 | (2R)-2-hydroxy-3-phosphonooxypropanoic acid | OSJPPGNTCRNQQC-UWTATZPHSA-N |
788 | 230.10 | C5H11O8P | ![]() |
CID: 439184 | [(2R,3R)-2,3,5-trihydroxy-4-oxopentyl] dihydrogen phosphate | FNZLKVNUWIIPSJ-UHNVWZDZSA-N |
789 | 342.29 | C12H22O11 | ![]() |
CID: 439193 | (3R,4S,5S,6R)-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxymethyl]tetrahydropyran-2,3,4,5-tetrol | DLRVVLDZNNYCBX-RTPHMHGBSA-N |
790 | 106.07 | C3H6O4 | ![]() |
CID: 439194 | (2R)-2,3-dihydroxypropanoic acid | RBNPOMFGQQGHHO-UWTATZPHSA-N |
791 | 154.25 | C4H10O2S2 | ![]() |
CID: 439196 | (2R,3R)-1,4-dimercaptobutane-2,3-diol | VHJLVAABSRFDPM-IMJSIDKUSA-N |
792 | 194.13 | C6H10O7 | ![]() |
CID: 439215 | (2S,3R,4S,5R)-3,4,5,6-tetrahydroxy-2-tetrahydropyrancarboxylic acid | AEMOLEFTQBMNLQ-YMDCURPLSA-N |
793 | 158.11 | C5H6N2O4 | ![]() |
CID: 439216 | (4S)-2,6-dioxo-4-hexahydropyrimidinecarboxylic acid | UFIVEPVSAGBUSI-REOHCLBHSA-N |
794 | 129.15 | C6H11NO2 | ![]() |
CID: 439227 | (2S)-2-piperidinecarboxylic acid | HXEACLLIILLPRG-YFKPBYRVSA-N |
795 | 174.19 | C7H14N2O3 | ![]() |
CID: 439232 | (2S)-2-acetamido-5-aminopentanoic acid | JRLGPAXAGHMNOL-LURJTMIESA-N |
796 | 150.12 | C5H10O5 | ![]() |
CID: 439240 | (3S,4S,5R)-tetrahydropyran-2,3,4,5-tetrol | SRBFZHDQGSBBOR-AGQMPKSLSA-N |
797 | 504.43 | C18H32O16 | ![]() |
CID: 439242 | (2R,3R,4S,5S,6R)-2-[[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)-2-tetrahydrofuranyl]oxy]-6-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxymethyl]tetrahydropyran-3,4,5-triol | MUPFEKGTMRGPLJ-ZQSKZDJDSA-N |
798 | 272.25 | C15H12O5 | ![]() |
CID: 439246 | (2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-chromanone | FTVWIRXFELQLPI-ZDUSSCGKSA-N |
799 | 220.22 | C11H12N2O3 | ![]() |
CID: 439280 | (2S)-2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acid | LDCYZAJDBXYCGN-VIFPVBQESA-N |
800 | 180.15 | C6H12O6 | ![]() |
CID: 439312 | (3S,4S,5R)-2-(hydroxymethyl)tetrahydropyran-2,3,4,5-tetrol | LKDRXBCSQODPBY-OEXCPVAWSA-N |
801 | 154.25 | C4H10O2S2 | ![]() |
CID: 439352 | (2R,3S)-1,4-dimercaptobutane-2,3-diol | VHJLVAABSRFDPM-ZXZARUISSA-N |
802 | 178.13 | C6H10O6 | ![]() |
CID: 439373 | (3S,4R,5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2-tetrahydrofuranone | SXZYCXMUPBBULW-SKNVOMKLSA-N |
803 | 161.15 | C6H11NO4 | ![]() |
CID: 439377 | (2S)-2-(methylamino)pentanedioic acid | XLBVNMSMFQMKEY-BYPYZUCNSA-N |
804 | 219.19 | C8H13NO6 | ![]() |
CID: 439406 | (2S)-2-amino-4-(4-hydroxy-1,4-dioxobutoxy)butanoic acid | GNISQJGXJIDKDJ-YFKPBYRVSA-N |
805 | 342.29 | C12H22O11 | ![]() |
CID: 439451 | (1R,2S,4R,5R)-6-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]cyclohexane-1,2,3,4,5-pentol | VCWMRQDBPZKXKG-SPBUTQSFSA-N |
806 | 304.25 | C15H12O7 | ![]() |
CID: 439533 | (2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-chromanone | CXQWRCVTCMQVQX-LSDHHAIUSA-N |
807 | 342.29 | C12H22O11 | ![]() |
CID: 439559 | (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(2R,3S,4S)-3,4,5-trihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]methoxy]tetrahydropyran-3,4,5-triol | PVXPPJIGRGXGCY-TZLCEDOOSA-N |
808 | 268.35 | C8H16N2O4S2 | ![]() |
CID: 439579 | (2S)-2-amino-4-[(3S)-3-amino-4-hydroxy-4-oxobutyl]disulfanylbutanoic acid | ZTVZLYBCZNMWCF-WDSKDSINSA-N |
809 | 504.43 | C18H32O16 | ![]() |
CID: 439586 | (2R,3R,4S,5S,6R)-2-[[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)-3-tetrahydropyranyl]oxy]-3-tetrahydropyranyl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | FYGDTMLNYKFZSV-DZOUCCHMSA-N |
810 | 152.14 | C8H8O3 | ![]() |
CID: 439616 | (2S)-2-hydroxy-2-phenylacetic acid | IWYDHOAUDWTVEP-ZETCQYMHSA-N |
811 | 666.57 | C24H42O21 | ![]() |
CID: 439626 | (2S,3R,4S,5S,6R)-2-[[(2R,3S,4R,5R,6S)-6-[[(2R,3S,4R,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)-3-tetrahydropyranyl]oxy]-3-tetrahydropyranyl]oxy]-4,5-dihydroxy-2-(hydroxymethyl)-3-tetrahydropyranyl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | LUEWUZLMQUOBSB-YQGOCCRESA-N |
812 | 120.10 | C4H8O4 | ![]() |
CID: 439665 | (2S,3R)-2,3,4-trihydroxybutanal | YTBSYETUWUMLBZ-QWWZWVQMSA-N |
813 | 370.26 | C12H18O13 | ![]() |
CID: 439694 | (2S,3R,4S,5R,6S)-6-[[(2S,3R,4R,5R)-2-carboxy-4,5,6-trihydroxy-3-tetrahydropyranyl]oxy]-3,4,5-trihydroxy-2-tetrahydropyrancarboxylic acid | IGSYEZFZPOZFNC-LKIWRGPLSA-N |
814 | 114.10 | C4H6N2O2 | ![]() |
CID: 439742 | (2S)-2-amino-3-cyanopropanoic acid | BXRLWGXPSRYJDZ-VKHMYHEASA-N |
815 | 164.15 | C6H12O5 | ![]() |
CID: 439746 | (3R,4S,5S,6R)-6-methyltetrahydropyran-2,3,4,5-tetrol | SHZGCJCMOBCMKK-GASJEMHNSA-N |
816 | 422.27 | C12H23O14P | ![]() |
CID: 439762 | [(2R,3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-tetrahydrofuranyl]methyl dihydrogen phosphate | PJTTXANTBQDXME-UGDNZRGBSA-N |
817 | 148.11 | C5H8O5 | ![]() |
CID: 439766 | (2R)-2-hydroxy-2-methylbutanedioic acid | XFTRTWQBIOMVPK-RXMQYKEDSA-N |
818 | 246.26 | C13H14N2O3 | ![]() |
CID: 439917 | (2R)-2-acetamido-3-(1H-indol-3-yl)propanoic acid | DZTHIGRZJZPRDV-GFCCVEGCSA-N |
819 | 260.13 | C6H13O9P | ![]() |
CID: 439958 | [(2R,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexyl] dihydrogen phosphate | VFRROHXSMXFLSN-SLPGGIOYSA-N |
820 | 199.16 | C7H9N3O4 | ![]() |
CID: 440053 | (2S)-2-amino-3-(2,4-dioxo-1-pyrimidinyl)propanoic acid | FACUYWPMDKTVFU-BYPYZUCNSA-N |
821 | 504.43 | C18H32O16 | ![]() |
CID: 440080 | (2R,3R,4S,5S,6R)-2-[[(2S,3S,4S,5R)-2-[[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)-2-tetrahydrofuranyl]oxymethyl]-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | VAWYEUIPHLMNNF-OESPXIITSA-N |
822 | 288.42 | C19H28O2 | ![]() |
CID: 440114 | (5R,8R,9S,10S,13S,14S)-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-3,17-dione | RAJWOBJTTGJROA-QJISAEMRSA-N |
823 | 189.27 | C9H21N2O2 | ![]() |
CID: 440121 | [(5S)-5-amino-6-hydroxy-6-oxohexyl]-trimethylammonium | MXNRLFUSFKVQSK-QMMMGPOBSA-O |
824 | 288.38 | C18H24O3 | ![]() |
CID: 440168 | (6R,8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,6,17-triol | QZZRQURPSRWTLG-UXCAXZQLSA-N |
825 | 183.20 | C8H13N3O2 | ![]() |
CID: 440274 | (2S)-2-(dimethylamino)-3-(1H-imidazol-5-yl)propanoic acid | IMOBSLOLPCWZKQ-ZETCQYMHSA-N |
826 | 162.18 | C10H10O2 | ![]() |
CID: 440294 | (1R,2S)-1,2-dihydronaphthalene-1,2-diol | QPUHWUSUBHNZCG-VHSXEESVSA-N |
827 | 198.17 | C8H10N2O4 | ![]() |
CID: 440473 | (2S)-2-amino-3-(3-hydroxy-4-oxo-1-pyridyl)propanoic acid | WZNJWVWKTVETCG-YFKPBYRVSA-N |
828 | 428.73 | C30H52O | ![]() |
CID: 440560 | (3S,5R,10S,13R,14R,17R)-17-[(1R)-1,5-dimethylhexyl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol | MBZYKEVPFYHDOH-BQNIITSRSA-N |
829 | 131.12 | C5H9NO3 | ![]() |
CID: 440575 | (2S,3S)-3-hydroxy-2-pyrrolidinecarboxylic acid | BJBUEDPLEOHJGE-IMJSIDKUSA-N |
830 | 286.36 | C18H22O3 | ![]() |
CID: 440623 | (8R,9S,13S,14S)-2,3-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one | SWINWPBPEKHUOD-JPVZDGGYSA-N |
831 | 300.39 | C19H24O3 | ![]() |
CID: 440624 | (8R,9S,13S,14S)-3-hydroxy-2-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one | WHEUWNKSCXYKBU-QPWUGHHJSA-N |
832 | 342.29 | C12H22O11 | ![]() |
CID: 440658 | (3R,4S,5S,6R)-6-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxymethyl]tetrahydropyran-2,3,4,5-tetrol | DLRVVLDZNNYCBX-ABXHMFFYSA-N |
833 | 174.10 | C6H6O6 | ![]() |
CID: 440667 | (5R)-5-[(1S)-1,2-dihydroxyethyl]tetrahydrofuran-2,3,4-trione | SBJKKFFYIZUCET-JLAZNSOCSA-N |
834 | 332.47 | C21H32O3 | ![]() |
CID: 440705 | 2-hydroxy-1-(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)ethanone | MOIQRAOBRXUWGN-UHFFFAOYSA-N |
835 | 104.10 | C4H8O3 | ![]() |
CID: 440864 | (2S)-2-hydroxybutanoic acid | AFENDNXGAFYKQO-VKHMYHEASA-N |
836 | 136.23 | C10H16 | ![]() |
CID: 440917 | (4R)-4-isopropenyl-1-methylcyclohexene | XMGQYMWWDOXHJM-JTQLQIEISA-N |
837 | 272.25 | C12H16O7 | ![]() |
CID: 440936 | (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)tetrahydropyran-3,4,5-triol | BJRNKVDFDLYUGJ-RMPHRYRLSA-N |
838 | 180.15 | C6H12O6 | ![]() |
CID: 441032 | (3S,4R,5S,6R)-6-(hydroxymethyl)tetrahydropyran-2,3,4,5-tetrol | WQZGKKKJIJFFOK-RSVSWTKNSA-N |
839 | 180.15 | C6H12O6 | ![]() |
CID: 441035 | (3S,4S,5R,6R)-6-(hydroxymethyl)tetrahydropyran-2,3,4,5-tetrol | WQZGKKKJIJFFOK-WHZQZERISA-N |
840 | 162.14 | C6H10O5 | ![]() |
CID: 441040 | (2S)-2-[(2S,3S,4R)-3,4-dihydroxy-2-tetrahydrofuranyl]-2-hydroxyacetaldehyde | WZYRMLAWNVOIEX-ARQDHWQXSA-N |
841 | 342.29 | C12H22O11 | ![]() |
CID: 441422 | (2R,3R,4S,5S,6R)-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxymethyl]tetrahydropyran-2,3,4,5-tetrol | DLRVVLDZNNYCBX-LIZSDCNHSA-N |
842 | 449.38 | C21H21O11 | ![]() |
CID: 441667 | (2S,3R,4S,5S,6R)-2-[[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-chromenyliumyl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | RKWHWFONKJEUEF-GQUPQBGVSA-O |
843 | 580.53 | C27H32O14 | ![]() |
CID: 442428 | (2S)-7-[[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-2-tetrahydropyranyl]oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4-chromanone | DFPMSGMNTNDNHN-ZPHOTFPESA-N |
844 | 610.56 | C28H34O15 | ![]() |
CID: 442439 | (2S)-7-[[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-2-tetrahydropyranyl]oxy]-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-chromanone | ARGKVCXINMKCAZ-UZRWAPQLSA-N |
845 | 154.24 | C10H18O | ![]() |
CID: 443163 | (1R,2R,5R)-5-isopropenyl-2-methylcyclohexanol | KRCZYMFUWVJCLI-OPRDCNLKSA-N |
846 | 149.10 | C4H7NO5 | ![]() |
CID: 443239 | (2S,3S)-2-amino-3-hydroxybutanedioic acid | YYLQUHNPNCGKJQ-LWMBPPNESA-N |
847 | 183.16 | C8H9NO4 | ![]() |
CID: 443586 | (2S)-2-amino-2-(3,5-dihydroxyphenyl)acetic acid | HOOWCUZPEFNHDT-ZETCQYMHSA-N |
848 | 465.38 | C21H21O12 | ![]() |
CID: 443650 | (2S,3R,4S,5S,6R)-2-[[5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3-chromenyliumyl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | XENHPQQLDPAYIJ-PEVLUNPASA-O |
849 | 479.41 | C22H23O12 | ![]() |
CID: 443651 | (2S,3R,4S,5S,6R)-2-[[2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-3-chromenyliumyl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | CCQDWIRWKWIUKK-QKYBYQKWSA-O |
850 | 493.43 | C23H25O12 | ![]() |
CID: 443652 | (2S,3R,4S,5S,6R)-2-[[5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-chromenyliumyl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | PXUQTDZNOHRWLI-OXUVVOBNSA-O |
851 | 463.41 | C22H23O11 | ![]() |
CID: 443654 | (2S,3R,4S,5S,6R)-2-[[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-chromenyliumyl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | ZZWPMFROUHHAKY-OUUKCGNVSA-O |
852 | 786.55 | C27H34N9O15P2 | ![]() |
CID: 444188 | [(2R,3S,4R,5R)-5-(6-amino-9-purinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl [[(2R,3S,4S)-5-(7,8-dimethyl-2,4-dioxo-1H-benzo[g]pteridin-10-ium-10-yl)-2,3,4-trihydroxypentoxy]-hydroxyphosphoryl] hydrogen phosphate | IMGVNJNCCGXBHD-UYBVJOGSSA-O |
853 | 174.10 | C6H6O6 | ![]() |
CID: 444212 | (E)-1-propene-1,2,3-tricarboxylic acid | GTZCVFVGUGFEME-HNQUOIGGSA-N |
854 | 116.07 | C4H4O4 | ![]() |
CID: 444266 | maleic acid | VZCYOOQTPOCHFL-UPHRSURJSA-N |
855 | 150.08 | C4H6O6 | ![]() |
CID: 444305 | (2R,3R)-2,3-dihydroxybutanedioic acid | FEWJPZIEWOKRBE-JCYAYHJZSA-N |
856 | 148.15 | C9H8O2 | ![]() |
CID: 444539 | (E)-3-phenyl-2-propenoic acid | WBYWAXJHAXSJNI-VOTSOKGWSA-N |
857 | 396.64 | C28H44O | ![]() |
CID: 444679 | (3S,9S,10R,13R,14R,17R)-10,13-dimethyl-17-[(E,1R,4R)-1,4,5-trimethylhex-2-enyl]-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol | DNVPQKQSNYMLRS-APGDWVJJSA-N |
858 | 166.17 | C9H10O3 | ![]() |
CID: 444718 | (2S)-2-hydroxy-3-phenylpropanoic acid | VOXXWSYKYCBWHO-QMMMGPOBSA-N |
859 | 300.43 | C20H28O2 | ![]() |
CID: 444795 | (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoic acid | SHGAZHPCJJPHSC-YCNIQYBTSA-N |
860 | 304.46 | C20H32O2 | ![]() |
CID: 444899 | (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid | YZXBAPSDXZZRGB-DOFZRALJSA-N |
861 | 116.07 | C4H4O4 | ![]() |
CID: 444972 | fumaric acid | VZCYOOQTPOCHFL-OWOJBTEDSA-N |
862 | 222.36 | C15H26O | ![]() |
CID: 445070 | (2E,6E)-3,7,11-trimethyl-1-dodeca-2,6,10-trienol | CRDAMVZIKSXKFV-YFVJMOTDSA-N |
863 | 228.24 | C14H12O3 | ![]() |
CID: 445154 | 5-[(E)-2-(4-hydroxyphenyl)vinyl]benzene-1,3-diol | LUKBXSAWLPMMSZ-OWOJBTEDSA-N |
864 | 254.40 | C16H30O2 | ![]() |
CID: 445638 | (Z)-9-hexadecenoic acid | SECPZKHBENQXJG-FPLPWBNLSA-N |
865 | 282.46 | C18H34O2 | ![]() |
CID: 445639 | (Z)-9-octadecenoic acid | ZQPPMHVWECSIRJ-KTKRTIGZSA-N |
866 | 194.18 | C10H10O4 | ![]() |
CID: 445858 | (E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid | KSEBMYQBYZTDHS-HWKANZROSA-N |
867 | 194.13 | C6H10O7 | ![]() |
CID: 445929 | (2S,3R,4S,5R,6S)-3,4,5,6-tetrahydroxy-2-tetrahydropyrancarboxylic acid | AEMOLEFTQBMNLQ-BKBMJHBISA-N |
868 | 290.44 | C19H30O2 | ![]() |
CID: 446188 | (8R,9S,10R,13S,14S,17S)-10,13-dimethyl-2,3,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol | BTTWKVFKBPAFDK-SSCHMFMQSA-N |
869 | 180.15 | C6H12O6 | ![]() |
CID: 448388 | (2R,3R,4R,5S,6R)-6-(hydroxymethyl)tetrahydropyran-2,3,4,5-tetrol | WQZGKKKJIJFFOK-QZABAPFNSA-N |
870 | 219.24 | C10H13N5O | ![]() |
CID: 449093 | (E)-2-methyl-4-(7H-purin-6-ylamino)-2-buten-1-ol | UZKQTCBAMSWPJD-FARCUNLSSA-N |
871 | 312.53 | C20H40O2 | ![]() |
CID: 468706 | (7R,11R)-3,7,11,15-tetramethylhexadecanoic acid | RLCKHJSFHOZMDR-PWCSWUJKSA-N |
872 | 342.29 | C12H22O11 | ![]() |
CID: 493593 | (2R,3R,5R)-2,3,5,6-tetrahydroxy-4-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]hexanal | DKXNBNKWCZZMJT-HWCAIPQBSA-N |
873 | 276.47 | C11H24O4Si2 | ![]() |
CID: 523334 | 4-trimethylsilyloxy-5-(trimethylsilyloxymethyl)-2-tetrahydrofuranone | IKMKBKLESWIEFA-UHFFFAOYSA-N |
874 | 420.66 | C27H48O3 | ![]() |
CID: 537036 | 17-(1,5-dimethylhexyl)-10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5,6-triol | YMMFNKXZULYSOQ-UHFFFAOYSA-N |
875 | 238.30 | C9H18O5S | ![]() |
CID: 552632 | 2-(hydroxymethyl)-6-(isopropylthio)tetrahydropyran-3,4,5-triol | BPHPUYQFMNQIOC-UHFFFAOYSA-N |
876 | 131.12 | C5H9NO3 | ![]() |
CID: 559314 | 3-hydroxy-2-pyrrolidinecarboxylic acid | BJBUEDPLEOHJGE-UHFFFAOYSA-N |
877 | 282.46 | C18H34O2 | ![]() |
CID: 637517 | (E)-9-octadecenoic acid | ZQPPMHVWECSIRJ-MDZDMXLPSA-N |
878 | 162.18 | C10H10O2 | ![]() |
CID: 637520 | (E)-3-phenyl-2-propenoic acid methyl ester | CCRCUPLGCSFEDV-BQYQJAHWSA-N |
879 | 164.15 | C9H8O3 | ![]() |
CID: 637540 | (E)-3-(2-hydroxyphenyl)-2-propenoic acid | PMOWTIHVNWZYFI-AATRIKPKSA-N |
880 | 164.15 | C9H8O3 | ![]() |
CID: 637541 | (E)-3-(3-hydroxyphenyl)-2-propenoic acid | KKSDGJDHHZEWEP-SNAWJCMRSA-N |
881 | 164.15 | C9H8O3 | ![]() |
CID: 637542 | (E)-3-(4-hydroxyphenyl)-2-propenoic acid | NGSWKAQJJWESNS-ZZXKWVIFSA-N |
882 | 154.24 | C10H18O | ![]() |
CID: 637566 | (2E)-3,7-dimethyl-1-octa-2,6-dienol | GLZPCOQZEFWAFX-JXMROGBWSA-N |
883 | 224.21 | C11H12O5 | ![]() |
CID: 637775 | (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenoic acid | PCMORTLOPMLEFB-ONEGZZNKSA-N |
884 | 152.23 | C10H16O | ![]() |
CID: 638011 | (2E)-3,7-dimethylocta-2,6-dienal | WTEVQBCEXWBHNA-JXMROGBWSA-N |
885 | 192.29 | C13H20O | ![]() |
CID: 638014 | (E)-4-(2,6,6-trimethyl-1-cyclohexenyl)-3-buten-2-one | PSQYTAPXSHCGMF-BQYQJAHWSA-N |
886 | 285.33 | C17H19NO3 | ![]() |
CID: 638024 | (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-(1-piperidyl)-1-penta-2,4-dienone | MXXWOMGUGJBKIW-YPCIICBESA-N |
887 | 326.25 | C14H14O9 | ![]() |
CID: 641605 | (2S,3S)-2-hydroxy-3-[(E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoallyloxy]butanedioic acid | XIWXUSFCUBAMFH-SCBUBVSKSA-N |
888 | 312.22 | C13H12O9 | ![]() |
CID: 642609 | (2S,3S)-2-[(E)-3-(3,4-dihydroxyphenyl)-1-oxoallyloxy]-3-hydroxybutanedioic acid | SWGKAHCIOQPKFW-LOMYTOQZSA-N |
889 | 137.17 | C8H11NO | ![]() |
CID: 643217 | (1S)-2-amino-1-phenylethanol | ULSIYEODSMZIPX-MRVPVSSYSA-N |
890 | 130.09 | C5H6O4 | ![]() |
CID: 643798 | (Z)-2-methyl-2-butenedioic acid | HNEGQIOMVPPMNR-IHWYPQMZSA-N |
891 | 268.43 | C17H32O2 | ![]() |
CID: 643801 | (Z)-9-hexadecenoic acid methyl ester | IZFGRAGOVZCUFB-HJWRWDBZSA-N |
892 | 154.24 | C10H18O | ![]() |
CID: 643820 | (2Z)-3,7-dimethyl-1-octa-2,6-dienol | GLZPCOQZEFWAFX-YFHOEESVSA-N |
893 | 785.54 | C27H33N9O15P2 | ![]() |
CID: 643975 | [(2R,3S,4R,5R)-5-(6-amino-9-purinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl [[(2R,3S,4S)-5-(7,8-dimethyl-2,4-dioxo-10-benzo[g]pteridinyl)-2,3,4-trihydroxypentoxy]-hydroxyphosphoryl] hydrogen phosphate | VWWQXMAJTJZDQX-UYBVJOGSSA-N |
894 | 150.12 | C5H10O5 | ![]() |
CID: 644160 | (2R,3S,4R)-2,3,4,5-tetrahydroxypentanal | PYMYPHUHKUWMLA-VPENINKCSA-N |
895 | 238.30 | C9H18O5S | ![]() |
CID: 656894 | (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(isopropylthio)tetrahydropyran-3,4,5-triol | BPHPUYQFMNQIOC-NXRLNHOXSA-N |
896 | 244.24 | C14H12O4 | ![]() |
CID: 667639 | 5-[(E)-2-(3,4-dihydroxyphenyl)vinyl]benzene-1,3-diol | CDRPUGZCRXZLFL-OWOJBTEDSA-N |
897 | 218.25 | C12H14N2O2 | ![]() |
CID: 676159 | (2S)-2-amino-3-(1-methyl-3-indolyl)propanoic acid | ZADWXFSZEAPBJS-JTQLQIEISA-N |
898 | 180.15 | C9H8O4 | ![]() |
CID: 689043 | (E)-3-(3,4-dihydroxyphenyl)-2-propenoic acid | QAIPRVGONGVQAS-DUXPYHPUSA-N |
899 | 271.31 | C16H17NO3 | ![]() |
CID: 725701 | (2S)-2-amino-3-[4-(phenylmethoxy)phenyl]propanoic acid | KAFHLONDOVSENM-HNNXBMFYSA-N |
900 | 138.12 | C6H6N2O2 | ![]() |
CID: 736715 | (E)-3-(1H-imidazol-5-yl)-2-propenoic acid | LOIYMIARKYCTBW-OWOJBTEDSA-N |
901 | 196.28 | C12H20O2 | ![]() |
CID: 1549026 | acetic acid [(2E)-3,7-dimethylocta-2,6-dienyl] ester | HIGQPQRQIQDZMP-DHZHZOJOSA-N |
902 | 224.21 | C11H12O5 | ![]() |
CID: 1549091 | (Z)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenoic acid | PCMORTLOPMLEFB-ARJAWSKDSA-N |
903 | 180.20 | C10H12O3 | ![]() |
CID: 1549095 | 4-[(E)-3-hydroxyprop-1-enyl]-2-methoxyphenol | JMFRWRFFLBVWSI-NSCUHMNNSA-N |
904 | 222.36 | C15H26O | ![]() |
CID: 1549107 | (2Z,6Z)-3,7,11-trimethyl-1-dodeca-2,6,10-trienol | CRDAMVZIKSXKFV-FBXUGWQNSA-N |
905 | 180.15 | C9H8O4 | ![]() |
CID: 1549111 | (Z)-3-(3,4-dihydroxyphenyl)-2-propenoic acid | QAIPRVGONGVQAS-RQOWECAXSA-N |
906 | 80.097 | C2H5NO2 | ![]() |
CID: 2723970 | 2,2-dideuterio-2-(dideuterioamino)acetic acid deuterio ester | DHMQDGOQFOQNFH-LGLHGEJLSA-N |
907 | 180.15 | C6H12O6 | ![]() |
CID: 2724552 | (2S,3S,4S,5R)-2-(hydroxymethyl)tetrahydropyran-2,3,4,5-tetrol | LKDRXBCSQODPBY-VANKVMQKSA-N |
908 | 128.21 | C8H16O | ![]() |
CID: 2724898 | (3S)-1-octen-3-ol | VSMOENVRRABVKN-MRVPVSSYSA-N |
909 | 105.13 | C4H11NO2 | ![]() |
CID: 2734122 | 3-(methylamino)propane-1,2-diol | WOMTYMDHLQTCHY-UHFFFAOYSA-N |
910 | 344.31 | C12H24O11 | ![]() |
CID: 3034828 | (3R,4R,5R)-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]hexane-1,2,3,4,5-pentol | SERLAGPUMNYUCK-BLEZHGCXSA-N |
911 | 103.09 | C4H7O3 | ![]() |
CID: 3037032 | 4-hydroxybutanoate | SJZRECIVHVDYJC-UHFFFAOYSA-M |
912 | 210.13 | C6H10O8 | ![]() |
CID: 3037582 | (2S,3R,4S,5R)-2,3,4,5-tetrahydroxyhexanedioic acid | DSLZVSRJTYRBFB-DUHBMQHGSA-N |
913 | 239.22 | C8H17NO7 | ![]() |
CID: 3084028 | N-[2,4,5-trihydroxy-6-(hydroxymethyl)-3-tetrahydropyranyl]acetamide hydrate | VVQPUTSNIMAJPT-UHFFFAOYSA-N |
914 | 199.09 | C4H10NO6P | ![]() |
CID: 3246323 | (2S,3R)-2-amino-3-phosphonooxybutanoic acid | USRGIUJOYOXOQJ-GBXIJSLDSA-N |
915 | 155.10 | C6H5NO4 | ![]() |
CID: 3505109 | 4-nitrobenzene-1,2-diol | XJNPNXSISMKQEX-UHFFFAOYSA-N |
916 | 506.45 | C18H34O16 | ![]() |
CID: 3625615 | 4-[[3,4-dihydroxy-6-(hydroxymethyl)-5-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-tetrahydropyranyl]oxy]hexane-1,2,3,5,6-pentol | XJCCHWKNFMUJFE-UHFFFAOYSA-N |
917 | 190.15 | C6H10N2O5 | ![]() |
CID: 3679006 | 2-ureidopentanedioic acid | LCQLHJZYVOQKHU-UHFFFAOYSA-N |
918 | 262.21 | C9H14N2O7 | ![]() |
CID: 4130574 | 2-[(2-amino-4-hydroxy-1,4-dioxobutyl)amino]pentanedioic acid | CKAJHWFHHFSCDT-UHFFFAOYSA-N |
919 | 180.15 | C6H12O6 | ![]() |
CID: 4180364 | 2,5-bis(hydroxymethyl)-1,4-dioxane-2,5-diol | KEQUNHIAUQQPAC-UHFFFAOYSA-N |
920 | 342.29 | C12H22O11 | ![]() |
CID: 4623424 | 2-(hydroxymethyl)-6-[[2,4,5-trihydroxy-6-(hydroxymethyl)-3-tetrahydropyranyl]oxy]tetrahydropyran-3,4,5-triol | HIWPGCMGAMJNRG-UHFFFAOYSA-N |
921 | 172.13 | C7H8O5 | ![]() |
CID: 4635868 | 3,4-dihydroxy-5-oxo-1-cyclohexenecarboxylic acid | XNEFHYFPRJBTJF-UHFFFAOYSA-N |
922 | 168.23 | C10H16O2 | ![]() |
CID: 5275520 | (2E)-3,7-dimethylocta-2,6-dienoic acid | ZHYZQXUYZJNEHD-VQHVLOKHSA-N |
923 | 299.49 | C18H37NO2 | ![]() |
CID: 5280335 | (E,2S,3R)-2-amino-4-octadecene-1,3-diol | WWUZIQQURGPMPG-KRWOKUGFSA-N |
924 | 410.71 | C30H50 | ![]() |
CID: 5280370 | (14E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene | YYGNTYWPHWGJRM-YMUIKIMESA-N |
925 | 284.26 | C16H12O5 | ![]() |
CID: 5280373 | 5,7-dihydroxy-3-(4-methoxyphenyl)-1-benzopyran-4-one | WUADCCWRTIWANL-UHFFFAOYSA-N |
926 | 268.26 | C16H12O4 | ![]() |
CID: 5280378 | 7-hydroxy-3-(4-methoxyphenyl)-1-benzopyran-4-one | HKQYGTCOTHHOMP-UHFFFAOYSA-N |
927 | 432.37 | C21H20O10 | ![]() |
CID: 5280441 | 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]-1-benzopyran-4-one | SGEWCQFRYRRZDC-VPRICQMDSA-N |
928 | 286.23 | C15H10O6 | ![]() |
CID: 5280445 | 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-1-benzopyran-4-one | IQPNAANSBPBGFQ-UHFFFAOYSA-N |
929 | 280.44 | C18H32O2 | ![]() |
CID: 5280450 | (9Z,12Z)-octadeca-9,12-dienoic acid | OYHQOLUKZRVURQ-HZJYTTRNSA-N |
930 | 115.08 | C4H5NO3 | ![]() |
CID: 5280451 | (Z)-4-amino-4-oxo-2-butenoic acid | FSQQTNAZHBEJLS-UPHRSURJSA-N |
931 | 192.16 | C10H8O4 | ![]() |
CID: 5280460 | 7-hydroxy-6-methoxy-1-benzopyran-2-one | RODXRVNMMDRFIK-UHFFFAOYSA-N |
932 | 130.09 | C5H6O4 | ![]() |
CID: 5280498 | (E)-2-pentenedioic acid | XVOUMQNXTGKGMA-OWOJBTEDSA-N |
933 | 210.22 | C11H14O4 | ![]() |
CID: 5280507 | 4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol | LZFOPEXOUVTGJS-ONEGZZNKSA-N |
934 | 178.18 | C10H10O3 | ![]() |
CID: 5280536 | (E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenal | DKZBBWMURDFHNE-NSCUHMNNSA-N |
935 | 176.16 | C10H8O3 | ![]() |
CID: 5280567 | 7-hydroxy-4-methyl-1-benzopyran-2-one | HSHNITRMYYLLCV-UHFFFAOYSA-N |
936 | 220.35 | C15H24O | ![]() |
CID: 5280598 | (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienal | YHRUHBBTQZKMEX-YFVJMOTDSA-N |
937 | 384.63 | C27H44O | ![]() |
CID: 5280795 | (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(1R)-1,5-dimethylhexyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylenecyclohexanol | QYSXJUFSXHHAJI-YRZJJWOYSA-N |
938 | 208.21 | C11H12O4 | ![]() |
CID: 5280802 | (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenal | CDICDSOGTRCHMG-ONEGZZNKSA-N |
939 | 464.37 | C21H20O12 | ![]() |
CID: 5280804 | 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-1-benzopyran-4-one | OVSQVDMCBVZWGM-QSOFNFLRSA-N |
940 | 164.15 | C9H8O3 | ![]() |
CID: 5280841 | (Z)-3-(2-hydroxyphenyl)-2-propenoic acid | PMOWTIHVNWZYFI-WAYWQWQTSA-N |
941 | 286.23 | C15H10O6 | ![]() |
CID: 5280863 | 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-1-benzopyran-4-one | IYRMWMYZSQPJKC-UHFFFAOYSA-N |
942 | 354.48 | C20H34O5 | ![]() |
CID: 5280886 | (Z)-7-[(1R,2R,3S,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]-5-heptenoic acid | PXGPLTODNUVGFL-ZWAKLXPCSA-N |
943 | 352.46 | C20H32O5 | ![]() |
CID: 5280887 | (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E)-3-oxooct-1-enyl]cyclopentyl]-5-heptenoic acid | LOLJEILMPWPILA-AMFHKTBMSA-N |
944 | 278.42 | C18H30O2 | ![]() |
CID: 5280934 | (9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid | DTOSIQBPPRVQHS-PDBXOOCHSA-N |
945 | 270.23 | C15H10O5 | ![]() |
CID: 5280961 | 5,7-dihydroxy-3-(4-hydroxyphenyl)-1-benzopyran-4-one | TZBJGXHYKVUXJN-UHFFFAOYSA-N |
946 | 460.43 | C22H24N2O9 | ![]() |
CID: 5280972 | (2Z,4S,4aR,5S,5aR,6S,12aS)-2-[amino(hydroxy)methylene]-4-(dimethylamino)-5,6,10,11,12a-pentahydroxy-6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione | FYDOORKXBWEKQM-GUQPPTOYSA-N |
947 | 254.23 | C15H10O4 | ![]() |
CID: 5281607 | 5,7-dihydroxy-2-phenyl-1-benzopyran-4-one | RTIXKCRFFJGDFG-UHFFFAOYSA-N |
948 | 316.26 | C16H12O7 | ![]() |
CID: 5281654 | 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-benzopyran-4-one | IZQSVPBOUDKVDZ-UHFFFAOYSA-N |
949 | 318.23 | C15H10O8 | ![]() |
CID: 5281672 | 3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-1-benzopyran-4-one | IKMDFBPHZNJCSN-UHFFFAOYSA-N |
950 | 302.23 | C15H10O7 | ![]() |
CID: 5281701 | 5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-1-benzopyran-4-one | ARSRJFRKVXALTF-UHFFFAOYSA-N |
951 | 254.23 | C15H10O4 | ![]() |
CID: 5281708 | 7-hydroxy-3-(4-hydroxyphenyl)-1-benzopyran-4-one | ZQSIJRDFPHDXIC-UHFFFAOYSA-N |
952 | 284.26 | C16H12O5 | ![]() |
CID: 5281804 | 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-1-benzopyran-4-one | KQMVAGISDHMXJJ-UHFFFAOYSA-N |
953 | 302.19 | C14H6O8 | ![]() |
CID: 5281855 | AFSDNFLWKVMVRB-UHFFFAOYSA-N | |
954 | 346.28 | C17H14O8 | ![]() |
CID: 5281953 | 3,5,7-trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-1-benzopyran-4-one | UZMAPBJVXOGOFT-UHFFFAOYSA-N |
955 | 347.53 | C22H37NO2 | ![]() |
CID: 5281969 | (5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)icosa-5,8,11,14-tetraenamide | LGEQQWMQCRIYKG-DOFZRALJSA-N |
956 | 417.62 | C26H43NO3 | ![]() |
CID: 5282106 | (Z)-N-[2-(3,4-dihydroxyphenyl)ethyl]-9-octadecenamide | QQBPLXNESPTPNU-KTKRTIGZSA-N |
957 | 332.26 | C16H12O8 | ![]() |
CID: 5282154 | 2-(3,4-dihydroxy-5-methoxyphenyl)-3,5,7-trihydroxy-1-benzopyran-4-one | CFYMYCCYMJIYAB-UHFFFAOYSA-N |
958 | 114.14 | C6H10O2 | ![]() |
CID: 5282707 | (E)-2-hexenoic acid | NIONDZDPPYHYKY-SNAWJCMRSA-N |
959 | 310.51 | C20H38O2 | ![]() |
CID: 5282768 | (Z)-11-icosenoic acid | BITHHVVYSMSWAG-KTKRTIGZSA-N |
960 | 356.53 | C21H40O4 | ![]() |
CID: 5283468 | (Z)-9-octadecenoic acid 2,3-dihydroxypropyl ester | RZRNAYUHWVFMIP-KTKRTIGZSA-N |
961 | 398.66 | C28H46O | ![]() |
CID: 5283772 | (1S)-3-[(E)-2-[(1R,3aR,7aR)-1-[(1R)-1,5-dimethylhexyl]-7a-methyl-1,2,3,3a,6,7-hexahydroinden-4-yl]-1-methylvinyl]-4-methyl-1-cyclohex-3-enol | LSMNSOVKLBDZMU-DUVJLZCRSA-N |
962 | 294.47 | C19H34O2 | ![]() |
CID: 5284421 | (9Z,12Z)-octadeca-9,12-dienoic acid methyl ester | WTTJVINHCBCLGX-NQLNTKRDSA-N |
963 | 97.092 | C5H5O2 | ![]() |
CID: 5288268 | 5-methyl-2-furanolate | FNEJQOIAGPBETK-UHFFFAOYSA-M |
964 | 103.11 | C4H9NO2 | ![]() |
CID: 5288725 | (2S)-2-(methylamino)propanoic acid | GDFAOVXKHJXLEI-VKHMYHEASA-N |
965 | 324.18 | C9H13N2O9P | ![]() |
CID: 5315131 | [(2S,3R,4S,5S)-5-(2,4-dioxo-1-pyrimidinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate | DJJCXFVJDGTHFX-PSQAKQOGSA-N |
966 | 100.15 | C6H12O | ![]() |
CID: 5318042 | (E)-2-hexen-1-ol | ZCHHRLHTBGRGOT-SNAWJCMRSA-N |
967 | 192.12 | C6H8O7 | ![]() |
CID: 5318532 | (1R,2S)-1-hydroxypropane-1,2,3-tricarboxylic acid | ODBLHEXUDAPZAU-ZAFYKAAXSA-N |
968 | 478.40 | C22H22O12 | ![]() |
CID: 5318644 | 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-1-benzopyran-4-one | CQLRUIIRRZYHHS-UVHBULKNSA-N |
969 | 356.53 | C21H40O4 | ![]() |
CID: 5319879 | (Z)-9-octadecenoic acid [2-hydroxy-1-(hydroxymethyl)ethyl] ester | UPWGQKDVAURUGE-KTKRTIGZSA-N |
970 | 296.53 | C20H40O | ![]() |
CID: 5320547 | (Z)-3,7,11,15-tetramethyl-2-hexadecen-1-ol | BOTWFXYSPFMFNR-HKWRFOASSA-N |
971 | 414.70 | C29H50O | ![]() |
CID: 5321342 | (3S,10R,13R,17R)-17-(4-ethyl-1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | KZJWDPNRJALLNS-LRWZISJQSA-N |
972 | 412.69 | C29H48O | ![]() |
CID: 5321515 | (10R,13R)-17-[(E)-4-ethyl-1,5-dimethylhex-2-enyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | HCXVJBMSMIARIN-JQSSNMPVSA-N |
973 | 242.23 | C12H10N4O2 | ![]() |
CID: 5326566 | 7,8-dimethyl-1H-benzo[g]pteridine-2,4-dione | ZJTJUVIJVLLGSP-UHFFFAOYSA-N |
974 | 144.12 | C6H8O4 | ![]() |
CID: 5351896 | (E)-3-hexenedioic acid | YHGNXQAFNHCBTK-OWOJBTEDSA-N |
975 | 384.63 | C27H44O | ![]() |
CID: 5353527 | (3E)-3-[(2E)-2-[1-(1,5-dimethylhexyl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylenecyclohexanol | QYSXJUFSXHHAJI-FWSOMWAYSA-N |
976 | 412.69 | C29H48O | ![]() |
CID: 5356634 | (5R,8R,9S,10S,13R,14S,17R)-17-[(E,1R,4S)-4-ethyl-1,5-dimethylhex-2-enyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one | RTLUSWHIKFIQFU-DALQDKCESA-N |
977 | 142.10 | C6H6O4 | ![]() |
CID: 5356793 | (2E,4E)-hexa-2,4-dienedioic acid | TXXHDPDFNKHHGW-ZPUQHVIOSA-N |
978 | 296.48 | C19H36O2 | ![]() |
CID: 5364509 | (Z)-9-octadecenoic acid methyl ester | QYDYPVFESGNLHU-KHPPLWFESA-N |
979 | 272.46 | C20H32 | ![]() |
CID: 5365927 | (6E,8E,10E)-2,6,11,15-tetramethylhexadeca-2,6,8,10,14-pentaene | ZUXCVSSOFQSXFF-LAJGPCJBSA-N |
980 | 296.53 | C20H40O | ![]() |
CID: 5366244 | (E)-3,7,11,15-tetramethyl-2-hexadecen-1-ol | BOTWFXYSPFMFNR-HMMYKYKNSA-N |
981 | 224.25 | C15H12O2 | ![]() |
CID: 5367146 | (E)-3-(2-hydroxyphenyl)-1-phenyl-2-propen-1-one | UDOOPSJCRMKSGL-ZHACJKMWSA-N |
982 | 143.14 | C6H9NO3 | ![]() |
CID: 5369191 | (E)-4-(ethylamino)-4-oxo-2-butenoic acid | HBQGCOWNLUOCBU-ONEGZZNKSA-N |
983 | 249.31 | C16H15N3 | ![]() |
CID: 5377207 | 1-[(Z)-3-indolylidenemethyl]-2-(4-methylphenyl)hydrazine | QMNOEPUUCJHLKA-ACCUITESSA-N |
984 | 198.06 | C4H7O7P | ![]() |
CID: 5459862 | [(2R,3R)-2,3-dihydroxy-4-oxobutyl] phosphate | NGHMDNPXVRFFGS-IUYQGCFVSA-L |
985 | 210.18 | C7H14O7 | ![]() |
CID: 5459879 | (3S,4R,5R,6R)-1,3,4,5,6,7-hexahydroxy-2-heptanone | HSNZZMHEPUFJNZ-SHUUEZRQSA-N |
986 | 342.29 | C12H22O11 | ![]() |
CID: 5460022 | (2R,3S,4R,5R)-2,3,4,5-tetrahydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]hexanal | AYRXSINWFIIFAE-YJOKQAJESA-N |
987 | 268.21 | C9H16O9 | ![]() |
CID: 5460194 | (2R)-3-hydroxy-2-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]propanoic acid | DDXCFDOPXBPUJC-SAYMMRJXSA-N |
988 | 210.13 | C6H10O8 | ![]() |
CID: 5460673 | (2S,3R,4R,5R)-2,3,4,5-tetrahydroxyhexanedioic acid | DSLZVSRJTYRBFB-AJSXGEPRSA-N |
989 | 342.29 | C12H22O11 | ![]() |
CID: 5460935 | (3S,4R,5R)-1,4,5,6-tetrahydroxy-3-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-hexanone | RULSWEULPANCDV-PIXUTMIVSA-N |
990 | 176.16 | C7H12O5 | ![]() |
CID: 5462261 | (2R,3S)-2-hydroxy-3-isopropylbutanedioic acid | RNQHMTFBUSSBJQ-CRCLSJGQSA-N |
991 | 442.37 | C22H18O10 | ![]() |
CID: 6419835 | 3,4,5-trihydroxybenzoic acid [(2S,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-chromanyl] ester | LSHVYAFMTMFKBA-CTNGQTDRSA-N |
992 | 365.23 | C10H16N5O8P | ![]() |
CID: 6419976 | [(2R,3S,4R,5R)-5-(6-amino-9-purinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate hydrate | ZOEFQKVADUBYKV-MCDZGGTQSA-N |
993 | 364.65 | C14H32O5Si3 | ![]() |
CID: 6427169 | (3S,4R,5S)-3,4-bis(trimethylsilyloxy)-5-(trimethylsilyloxymethyl)-2-tetrahydrofuranone | RJMKTJPGOIYTQZ-XQQFMLRXSA-N |
994 | 296.53 | C20H40O | ![]() |
CID: 6430833 | (Z,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-ol | BOTWFXYSPFMFNR-QYLFUYDXSA-N |
995 | 414.70 | C29H50O | ![]() |
CID: 6432744 | (3S)-17-(4-ethyl-1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | KZJWDPNRJALLNS-GDQWMHGZSA-N |
996 | 354.30 | C16H18O9 | ![]() |
CID: 6537496 | (1S,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)-1-oxoallyloxy]-1,4,5-trihydroxycyclohexanecarboxylic acid | CWVRJTMFETXNAD-VQWGVLBKSA-N |
997 | 303.31 | C12H21N3O6 | ![]() |
CID: 9882882 | (2S)-1-[(3S)-3-[[(3S)-3-amino-4-hydroxy-4-oxobutyl]amino]-4-hydroxy-4-oxobutyl]-2-azetidinecarboxylic acid | KRGPXXHMOXVMMM-CIUDSAMLSA-N |
998 | 306.26 | C15H14O7 | ![]() |
CID: 9882981 | (2S,3R)-2-(3,4,5-trihydroxyphenyl)chromane-3,5,7-triol | XMOCLSLCDHWDHP-DOMZBBRYSA-N |
999 | 93.117 | C3H7NO2 | ![]() |
CID: 12205373 | (2S)-2-amino-2,3,3,3-tetradeuteriopropanoic acid | QNAYBMKLOCPYGJ-IALWIIEESA-N |
1000 | 173.23 | C9H11NO2 | ![]() |
CID: 13000987 | (2S)-2-amino-2,3,3-trideuterio-3-(2,3,4,5,6-pentadeuteriophenyl)propanoic acid | COLNVLDHVKWLRT-WYMAAGAPSA-N |
1001 | 442.37 | C22H18O10 | ![]() |
CID: 15689618 | 3,4,5-trihydroxybenzoic acid [(2R,3S)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-5-chromanyl] ester | LVJJFMLUMNSUFN-LAUBAEHRSA-N |
1002 | 390.38 | C17H26O10 | ![]() |
CID: 16212335 | (1S,4aS,6S,7R,7aS)-6-hydroxy-7-methyl-1-[[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid methyl ester | AMBQHHVBBHTQBF-SQSCWSLKSA-N |
1003 | 392.69 | C27H46O | ![]() |
CID: 16213400 | (3S,8S,9S,10R,13R,14S,17R)-2,2,3,4,4,6-hexadeuterio-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-1,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-ol | HVYWMOMLDIMFJA-HHPLMCQASA-N |
1004 | 183.20 | C9H11NO3 | ![]() |
CID: 16213445 | (2S)-2-amino-3,3-dideuterio-3-(4-hydroxyphenyl)propanoic acid | OUYCCCASQSFEME-KETSZMSZSA-N |
1005 | 192.16 | C7H12O6 | ![]() |
CID: 16213610 | 1-[(2S,3S,4S,5R,6R)-3,4,5,6-tetrahydroxy-2-tetrahydropyranyl]ethanone | ZXTKSWFCRRTTMN-PAMBMQIZSA-N |
1006 | 187.19 | C6H12O6 | ![]() |
CID: 16217112 | (2S,3R,4S,5S,6R)-2,3,4,5,6-pentadeuterio-6-[dideuterio(hydroxy)methyl]tetrahydropyran-2,3,4,5-tetrol | WQZGKKKJIJFFOK-KKGCZVNTSA-N |
1007 | 344.31 | C12H24O11 | ![]() |
CID: 16217663 | (2S,3R,4R)-4-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]hexane-1,2,3,5,6-pentol | VQHSOMBJVWLPSR-IOWGVSMYSA-N |
1008 | 142.15 | C4H8N2O3 | ![]() |
CID: 16217724 | (2S)-2,3,3-trideuterio-2,4-bis(dideuterioamino)-4-oxobutanoic acid deuterio ester | DCXYFEDJOCDNAF-VYGMAKJPSA-N |
1009 | 235.19 | C8H13NO7 | ![]() |
CID: 16218892 | (2S,3S,4R,5R)-5-acetamido-3,4,6-trihydroxy-2-tetrahydropyrancarboxylic acid | KSOXQRPSZKLEOR-OEGLBHDSSA-N |
1010 | 358.29 | C12H22O12 | ![]() |
CID: 16219560 | (2R,3R,4R)-2,3,5,6-tetrahydroxy-4-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]hexanoic acid | JYTUSYBCFIZPBE-QLRGDERGSA-N |
1011 | 281.26 | C11H15N5O4 | ![]() |
CID: 16219662 | (5R)-2-(hydroxymethyl)-5-(6-imino-1-methyl-9-purinyl)tetrahydrofuran-3,4-diol | GFYLSDSUCHVORB-DFKYELRASA-N |
1012 | 210.18 | C7H14O7 | ![]() |
CID: 16219957 | (1R,2S,3R,4S,5R)-1-(hydroxymethyl)-7,8-dioxabicyclo[3.2.1]octane-2,3,4-triol hydrate | TXADMKCMMLBFTL-CQJQEINESA-N |
1013 | 194.18 | C7H14O6 | ![]() |
CID: 17751029 | (2R,3R,4S,5R,6R)-6-(hydroxymethyl)-2-methyltetrahydropyran-2,3,4,5-tetrol | YBLJYSTXRAWBBH-VOQCIKJUSA-N |