(8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-Propan-2-Yl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[a]Phenanthren-3-One
[CAS# 38388-19-1]

Identification

• Name: (8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-Propan-2-Yl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[a]Phenanthren-3-One
• Synonyms: (8S,9S,10R,13R,14S,17R)-17-Isopropyl-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-3-One; 20-Methylpregn-4-Ene-3-One; 23,24-Dinor-4-Cholen-3-One
• Molecular Formula: C₂₂H₃₄O
• Molecular Weight: 314.51
• CAS Registry Number: 38388-19-1
• SMILES: [C@@H]23CCC1=CC(CC[C@@]1([C@H]2CC[C@]4([C@H]3CC[C@@H]4C(C)C)C)C)=O
• InChI: 1S/C22H34O/c1-14(2)18-7-8-19-17-6-5-15-13-16(23)9-11-21(15,3)20(17)10-12-22(18,19)4/h13-14,17-20H,5-12H2,1-4H3/t17-,18+,19-,20-,21-,22+/m0/s1
• InChIKey: ATVHBCDLGLNZIR-GFJXEVPCSA-N

Properties

• Density: 1.018g/cm³ (Cal.)
• Boiling point: 421.318°C at 760 mmHg (Cal.)
• Flash point: 204.281°C (Cal.)