3-Oxo-12alpha-hydroxy-5beta-cholanoic Acid, TRC

CAS: 4185-01-7 Molecular Formula: C24 H38 O4 Molecular Weight (g/mol): 390.56 Synonym: Cholan-24-oic acid, 12-hydroxy-3-oxo-, (5β,12α)-,5β-Cholan-24-oic acid, 12α-hydroxy-3-oxo- (8CI),5β-Cholanic acid, 12α-hydroxy-3-oxo- (7CI),(5β,12α)-12-Hydroxy-3-oxocholan-24-oic acid,12α-Hydroxy-3-keto-5β-cholanoic acid,12α-Hydroxy-3-oxo-5β-chol-24-oic acid,12α-Hydroxy-3-oxo-5β-cholan-24-oic acid,12α-Hydroxy-3-oxo-5β-cholanic acid,12α-Hydroxy-3-oxo-5β-cholanoic acid,3-Oxo-12α-hydroxy-5β-cholanic acid,3-Oxo-12α-hydroxy-5β-cholanoic acid,3-Oxo-12α-hydroxycholan-24-oic acid,3-Oxodeoxycholic acid IUPAC Name: (4R)-4-[(5R,8R,9S,10S,12S,13R,14S,17R)-12-hydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid SMILES: C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4CC(=O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C