> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Acylaminobenzoic acid and derivatives
|
4-[(2-amino-4-oxo-1H-pteridin-6-yl)methyl-formylamino]benzoic acid
|
97575 |
Click to see
C1=CC(=CC=C1C(=O)O)N(CC2=CN=C3C(=N2)C(=O)N=C(N3)N)C=O
|
340.29 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Abscisic acids and derivatives
|
Abscisic acid
|
5280896 |
Click to see
CC1=CC(=O)CC(C1(C=CC(=CC(=O)O)C)O)(C)C
|
264.32 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
|
(4-Methoxy-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-6-yl) 2-methylprop-2-enoate
|
163033891 |
Click to see
CC1C(CCC2C1(C(C3=C(C2=O)OC=C3C)OC)C)OC(=O)C(=C)C
|
346.40 |
unknown |
https://doi.org/10.1002/CBER.19761090403 |
(4-Methoxy-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-6-yl) 3-methylbut-2-enoate
|
162884522 |
Click to see
CC1C(CCC2C1(C(C3=C(C2=O)OC=C3C)OC)C)OC(=O)C=C(C)C
|
360.40 |
unknown |
https://doi.org/10.1002/CBER.19761090403 |
(4S,4aR,5R,6S,8aR)-6-hydroxy-4-methoxy-3,4a,5-trimethyl-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-9-one
|
163087334 |
Click to see
CC1C(CCC2C1(C(C3=C(C2=O)OC=C3C)OC)C)O
|
278.34 |
unknown |
https://doi.org/10.1002/CBER.19761090403 |
[(4S,4aR,5R,6S,8aR)-4-methoxy-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-6-yl] 2-methylprop-2-enoate
|
163033892 |
Click to see
CC1C(CCC2C1(C(C3=C(C2=O)OC=C3C)OC)C)OC(=O)C(=C)C
|
346.40 |
unknown |
https://doi.org/10.1002/CBER.19761090403 |
[(4S,4aR,5R,6S,8aR)-4-methoxy-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-6-yl] 3-methylbut-2-enoate
|
162884523 |
Click to see
CC1C(CCC2C1(C(C3=C(C2=O)OC=C3C)OC)C)OC(=O)C=C(C)C
|
360.40 |
unknown |
https://doi.org/10.1002/CBER.19761090403 |
6-Hydroxy-4-methoxy-3,4a,5-trimethyl-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-9-one
|
163087333 |
Click to see
CC1C(CCC2C1(C(C3=C(C2=O)OC=C3C)OC)C)O
|
278.34 |
unknown |
https://doi.org/10.1002/CBER.19761090403 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Androstane steroids
|
(5S,6S,8S,9S,10S,11R,13S,14S)-6,11-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
|
92835934 |
Click to see
CC12CCCCC1C(CC3C2C(CC4(C3CCC4=O)C)O)O
|
306.40 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Androstane steroids / Androgens and derivatives
|
(3beta,5alpha,7alpha)-3,7-Dihydroxyandrostan-17-one
|
9815044 |
Click to see
CC12CCC(CC1CC(C3C2CCC4(C3CCC4=O)C)O)O
|
306.40 |
unknown |
via CMAUP database |
(3R,5R,7S,8R,9S,10S,13S,14S)-3,7-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
|
57386710 |
Click to see
CC12CCC(CC1CC(C3C2CCC4(C3CCC4=O)C)O)O
|
306.40 |
unknown |
via CMAUP database |
(3R,5R,8R,9S,10S,13S,14S,17S)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-7-one
|
69924431 |
Click to see
CC12CCC3C(C1CCC2O)C(=O)CC4C3(CCC(C4)O)C
|
306.40 |
unknown |
via CMAUP database |
(3R,5R,8R,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-7,17-dione
|
57386713 |
Click to see
CC12CCC(CC1CC(=O)C3C2CCC4(C3CCC4=O)C)O
|
304.40 |
unknown |
via CMAUP database |
(3R,5S,6S,8R,9S,10R,13S,14S)-3,6-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
|
69766330 |
Click to see
CC12CCC(CC1C(CC3C2CCC4(C3CCC4=O)C)O)O
|
306.40 |
unknown |
via CMAUP database |
(3S,5R,7R,8S,9S,10S,13R,14S,16S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,16-triol
|
99574281 |
Click to see
CC12CCC3C(C1CC(C2)O)C(CC4C3(CCC(C4)O)C)O
|
308.50 |
unknown |
via CMAUP database |
(3S,5R,7S,8S,9S,10S,13S,14S,16S)-3,7,16-trihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one
|
99572894 |
Click to see
CC12CCC(CC1CC(C3C2C(=O)CC4(C3CC(C4)O)C)O)O
|
322.40 |
unknown |
via CMAUP database |
(3S,5R,8S,9S,10S,13R,14S,16R)-3,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-7-one
|
99573267 |
Click to see
CC12CCC3C(C1CC(C2)O)C(=O)CC4C3(CCC(C4)O)C
|
306.40 |
unknown |
via CMAUP database |
(3S,5R,8S,9S,10S,13R,14S,16S)-3,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-7-one
|
99573266 |
Click to see
CC12CCC3C(C1CC(C2)O)C(=O)CC4C3(CCC(C4)O)C
|
306.40 |
unknown |
via CMAUP database |
(3S,5S,6S,8R,9S,10R,13S,14S)-3,6-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
|
15917986 |
Click to see
CC12CCC(CC1C(CC3C2CCC4(C3CCC4=O)C)O)O
|
306.40 |
unknown |
via CMAUP database |
(3S,5S,6S,8S,9S,10R,13R,14S,16R)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,6,16-triol
|
99574278 |
Click to see
CC12CCC3C(C1CC(C2)O)CC(C4C3(CCC(C4)O)C)O
|
308.50 |
unknown |
via CMAUP database |
(3S,5S,8S,9S,10R,13R,14S,16R)-3,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
|
99571962 |
Click to see
CC12CCC3C(C1CC(C2)O)CC(=O)C4C3(CCC(C4)O)C
|
306.40 |
unknown |
via CMAUP database |
(3S,5S,8S,9S,10R,13R,14S,16S)-3,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
|
99571961 |
Click to see
CC12CCC3C(C1CC(C2)O)CC(=O)C4C3(CCC(C4)O)C
|
306.40 |
unknown |
via CMAUP database |
(3S,5S,8S,9S,10S,11R,13S,14S,16S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,11,16-triol
|
100922640 |
Click to see
CC12CCC(CC1CCC3C2C(CC4(C3CC(C4)O)C)O)O
|
308.50 |
unknown |
via CMAUP database |
(3S,5S,8S,9S,10S,13S,14S,16R)-3,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one
|
99601533 |
Click to see
CC12CCC(CC1CCC3C2C(=O)CC4(C3CC(C4)O)C)O
|
306.40 |
unknown |
via CMAUP database |
(3S,5S,8S,9S,10S,13S,14S,16S)-3,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one
|
99575783 |
Click to see
CC12CCC(CC1CCC3C2C(=O)CC4(C3CC(C4)O)C)O
|
306.40 |
unknown |
via CMAUP database |
(5R,8S,9S,10R,13S,14S,17S)-5,17-dihydroxy-10,13-dimethyl-2,4,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
|
10979706 |
Click to see
CC12CCC3C(C1CCC2O)CCC4(C3(CCC(=O)C4)C)O
|
306.40 |
unknown |
via CMAUP database |
(5R,8S,9S,10S,13R,14S,16S)-16-hydroxy-10,13-dimethyl-2,4,5,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-dione
|
99571971 |
Click to see
CC12CCC3C(C1CC(C2)O)C(=O)CC4C3(CCC(=O)C4)C
|
304.40 |
unknown |
via CMAUP database |
(5S,6R,8S,9S,10R,13R,14S,16S)-6,16-dihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
|
99573707 |
Click to see
CC12CCC3C(C1CC(C2)O)CC(C4C3(CCC(=O)C4)C)O
|
306.40 |
unknown |
via CMAUP database |
(5S,6S,8S,9S,10R,13R,14S,16R)-6,16-dihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
|
99573706 |
Click to see
CC12CCC3C(C1CC(C2)O)CC(C4C3(CCC(=O)C4)C)O
|
306.40 |
unknown |
via CMAUP database |
(5S,6S,8S,9S,10R,13R,14S,16S)-6,16-dihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
|
99573705 |
Click to see
CC12CCC3C(C1CC(C2)O)CC(C4C3(CCC(=O)C4)C)O
|
306.40 |
unknown |
via CMAUP database |
(5S,6S,8S,9S,10S,11R,13S,14S)-6,11-dihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
|
99574441 |
Click to see
CC12CCCC1C3CC(C4CC(=O)CCC4(C3C(C2)O)C)O
|
306.40 |
unknown |
via CMAUP database |
(5S,8S,9R,10S,13S,14S,16R)-9,16-dihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,11-dione
|
99571360 |
Click to see
CC12CCC(=O)CC1CCC3C2(C(=O)CC4(C3CC(C4)O)C)O
|
320.40 |
unknown |
via CMAUP database |
(5S,8S,9R,10S,13S,14S,16S)-9,16-dihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,11-dione
|
99571358 |
Click to see
CC12CCC(=O)CC1CCC3C2(C(=O)CC4(C3CC(C4)O)C)O
|
320.40 |
unknown |
via CMAUP database |
(5S,8S,9S,10S,13S,14S,16R)-16-hydroxy-10,13-dimethyl-2,4,5,6,7,8,9,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
|
99574177 |
Click to see
CC12CCC(=O)CC1CCC3C2C(=O)CC4(C3CC(C4)O)C
|
304.40 |
unknown |
via CMAUP database |
(5S,8S,9S,10S,13S,14S,16S)-16-hydroxy-10,13-dimethyl-2,4,5,6,7,8,9,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
|
99574175 |
Click to see
CC12CCC(=O)CC1CCC3C2C(=O)CC4(C3CC(C4)O)C
|
304.40 |
unknown |
via CMAUP database |
11-Hydroxyandrosterone
|
21139727 |
Click to see
CC12CCC(CC1CCC3C2C(CC4(C3CCC4=O)C)O)O
|
306.40 |
unknown |
via CMAUP database |
11alpha-Hydroxy-5alpha-androstane-3,17-dione
|
101709630 |
Click to see
CC12CCC(=O)CC1CCC3C2C(CC4(C3CCC4=O)C)O
|
304.40 |
unknown |
via CMAUP database |
11alpha,16alpha-Dihydroxy-5alpha-androstan-3-one
|
100922644 |
Click to see
CC12CCC(=O)CC1CCC3C2C(CC4(C3CC(C4)O)C)O
|
306.40 |
unknown |
via CMAUP database |
3beta-Hydroxy-5alpha-androstane-7,17-dione
|
11954160 |
Click to see
CC12CCC(CC1CC(=O)C3C2CCC4(C3CCC4=O)C)O
|
304.40 |
unknown |
via CMAUP database |
5alpha-Androstan-11-one, 3alpha,17beta-dihydroxy-
|
10125601 |
Click to see
CC12CCC(CC1CCC3C2C(=O)CC4(C3CCC4O)C)O
|
306.40 |
unknown |
via CMAUP database |
5alpha-Androstan-3-one, 11alpha,17beta-dihydroxy-
|
22796602 |
Click to see
CC12CCC(=O)CC1CCC3C2C(CC4(C3CCC4O)C)O
|
306.40 |
unknown |
via CMAUP database |
5alpha-Androstan-3beta,17beta-diol-7-one
|
11868973 |
Click to see
CC12CCC3C(C1CCC2O)C(=O)CC4C3(CCC(C4)O)C
|
306.40 |
unknown |
via CMAUP database |
5alpha-Androstan-6-one, 3beta,17beta-dihydroxy-
|
11551286 |
Click to see
CC12CCC3C(C1CCC2O)CC(=O)C4C3(CCC(C4)O)C
|
306.40 |
unknown |
via CMAUP database |
5alpha-Androstane-3,7,17-trione
|
11266632 |
Click to see
CC12CCC(=O)CC1CC(=O)C3C2CCC4(C3CCC4=O)C
|
302.40 |
unknown |
via CMAUP database |
7-beta-Hydroxyepiandrosterone
|
9836181 |
Click to see
CC12CCC(CC1CC(C3C2CCC4(C3CCC4=O)C)O)O
|
306.40 |
unknown |
via CMAUP database |
Androstan-3-one, 6,17-dihydroxy-, (5alpha,6alpha,17beta)-
|
15838416 |
Click to see
CC12CCC3C(C1CCC2O)CC(C4C3(CCC(=O)C4)C)O
|
306.40 |
unknown |
via CMAUP database |
Androstan-6-one, 3,17-dihydroxy-, (3alpha,5alpha,17beta)-
|
15929496 |
Click to see
CC12CCC3C(C1CCC2O)CC(=O)C4C3(CCC(C4)O)C
|
306.40 |
unknown |
via CMAUP database |
Androstane-3,11,17-triol
|
57396177 |
Click to see
CC12CCC(CC1CCC3C2C(CC4(C3CCC4O)C)O)O
|
308.50 |
unknown |
via CMAUP database |
Androstane-3,17-dione, 6-hydroxy-, (5alpha,6alpha)-
|
22296022 |
Click to see
CC12CCC(=O)CC1C(CC3C2CCC4(C3CCC4=O)C)O
|
304.40 |
unknown |
via CMAUP database |
Androstane-3,6,17-triol
|
170796 |
Click to see
CC12CCC3C(C1CCC2O)CC(C4C3(CCC(C4)O)C)O
|
308.50 |
unknown |
via CMAUP database |
Jgd4N79M5A
|
68995028 |
Click to see
CC12CCC3C(C1CCC2O)C(CC4C3(CCC(C4)O)C)O
|
308.50 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid esters
|
10-Hydroxy-3-oxoestr-4-en-17-yl acetate
|
91691749 |
Click to see
CC(=O)OC1CCC2C1(CCC3C2CCC4=CC(=O)CCC34O)C
|
332.40 |
unknown |
via CMAUP database |
> Organic acids and derivatives / Carboxylic acids and derivatives / Dicarboxylic acids and derivatives
|
(E)-but-2-enedioate;hydron
|
21883788 |
Click to see
[H+].[H+].C(=CC(=O)[O-])C(=O)[O-]
|
116.07 |
unknown |
via CMAUP database |
Butanedioate;hydron
|
21952380 |
Click to see
[H+].[H+].C(CC(=O)[O-])C(=O)[O-]
|
118.09 |
unknown |
via CMAUP database |
Glutaric acid
|
743 |
Click to see
C(CC(=O)O)CC(=O)O
|
132.11 |
unknown |
via CMAUP database |
> Organic acids and derivatives / Hydroxy acids and derivatives / Alpha hydroxy acids and derivatives
|
2-Oxonioacetate
|
3698251 |
Click to see
C(C(=O)[O-])[OH2+]
|
76.05 |
unknown |
via CMAUP database |
> Organoheterocyclic compounds / Quinolines and derivatives / Quinoline carboxylic acids
|
Quininic acid
|
345824 |
Click to see
COC1=CC2=C(C=CN=C2C=C1)C(=O)O
|
203.19 |
unknown |
via CMAUP database |