3α-Hydroxy-7-oxo-5β-cholanic acid

• CAS: 4651-67-6
• Catalog Number: ACM4651676
• Category: Steroidal Compounds
• Molecular Weight: 390.56
• Molecular Formula: C₂₄H₃₈O₄
• Synonyms: 3α-Hydroxy-7-keto-5β-cholanic Acid; 3ALPHA-HYDROXY-7-OXO-5BETA-CHOLANIC ACID; 3a-Hydroxy-7-oxo-5b-cholanic acid; 3α-Hydroxy-7-oxo-5β-cholanic Acid
• IUPAC Name: (4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoicacid
• Canonical SMILES: CC(CCC(=O)O)C1CCC2C1(CCC3C2C(=O)CC4C3(CCC(C4)O)C)C
• InChI Key: DXOCDBGWDZAYRQ-AURDAFMXSA-N
• Boiling Point: 545.9ºC at 760 mmHg
• Melting Point: 205ºC
• Flash Point: 298ºC
• Density: 1.124g/cm³
• EC Number: 225-083-2
• Exact Mass: 390.27700
• Safety Description: 22-24/25