5α-Pregnan-3β-ol-20-one 3β-acetate

• Catalog Number: ACM906832
• Product Name: 5α-Pregnan-3β-ol-20-one 3β-acetate
• CAS: 906-83-2
• Category: Steroidal Compounds
• Synonyms: 20-Oxopregnan-3-yl acetate, pregnan-20-one, 3-(acetyloxy)-, 5-BETA-PREGNAN,20-ONE,3-ALPHA-YL-ACETATE, 906-83-2, InChI=1/C23H36O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h16-21H,5-13H2,1-4H
• IUPAC Name: [(3S,5S,8R,9S,10S,13S,14S,17R)-17-acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
• Molecular Weight: 360.53
• Molecular Formula: C₂₃H₃₆O₃
• Canonical SMILES: CC(=O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)OC(=O)C)C)C
• InChI Key: GFHOQCXDABGYAL-MVAZZOICSA-N
• Boiling Point: 443.7ºC at 760mmHg
• Flash Point: 189.4ºC
• Density: 1.07g/cm³
• Exact Mass: 360.26600
• H-Bond Acceptor: 3
• H-Bond Donor: 0
• WGK Germany: 3