(8S,9S,10S,13S,14S)-3,17-Dihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-Tetradecahydrocyclopenta[a]Phenanthren-11-One
[CAS# 77983-84-7]

Identification

• Name: (8S,9S,10S,13S,14S)-3,17-Dihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-Tetradecahydrocyclopenta[a]Phenanthren-11-One
• Synonyms: 3,17-Dihydroxyandrostan-11-One; 5Beta-Androstan-3Alpha,17Alpha-Diol-11-One; Androstan-11-One, 3,17-Dihydroxy-
• Molecular Formula: C₁₉H₃₀O₃
• Molecular Weight: 306.44
• CAS Registry Number: 77983-84-7
• SMILES: [C@@H]23CCC1CC(CC[C@@]1([C@H]2C(C[C@]4([C@H]3CCC4O)C)=O)C)O
• InChI: 1S/C19H30O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h11-14,16-17,20,22H,3-10H2,1-2H3/t11?,12?,13-,14-,16?,17+,18-,19-/m0/s1
• InChIKey: CEMLAYQDMWFPDU-HOSBWRAWSA-N

Properties

• Density: 1.158g/cm³ (Cal.)
• Boiling point: 454.743°C at 760 mmHg (Cal.)
• Flash point: 242.945°C (Cal.)