Type: | Metabolite |
PubChem: | 500165 |
DrugBank: | None |
IUPAC: | 4-(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)pentanoic acid |
Standard InChI: | InChI=1S/C24H40O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-21,25H,4-14H2,1-3H3,(H,26,27) |
Standard InChIKey: | SMEROWZSTRWXGI-UHFFFAOYSA-N |
SMILES: | CC(CCC(=O)O)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C |
Chemical Structure | Parent compounds name | Reaction name | Genus | Species | Reference |
---|---|---|---|---|---|
Chenodeoxycholic acid | Hydroxylation | Gut microbiota | Gut microbiota | 10.1016/S0016-5085(79)80079-7 | |
Ursodeoxycholic acid | Hydroxylation | Gut microbiota | Gut microbiota | 10.1016/S0016-5085(79)80079-7 |