(3S,8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-[(2R)-1-[(1R,2R,3S)-2-Methyl-3-Propan-2-Ylcyclopropyl]Propan-2-Yl]-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-3-Ol
[CAS# 132438-14-3]

Identification

• Name: (3S,8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-[(2R)-1-[(1R,2R,3S)-2-Methyl-3-Propan-2-Ylcyclopropyl]Propan-2-Yl]-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-3-Ol
• Synonyms: (3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-2-[(1R,2S,3R)-2-Isopropyl-3-Methyl-Cyclopropyl]-1-Methyl-Ethyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Ol; (3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-2-[(1R,2S,3R)-2-Isopropyl-3-Methylcyclopropyl]-1-Methylethyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Ol; (3S,8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-[(2R)-1-[(1R,2R,3S)-2-Methyl-3-Propan-2-Yl-Cyclopropyl]Propan-2-Yl]-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Ol
• Molecular Formula: C₂₉H₄₈O
• Molecular Weight: 412.70
• CAS Registry Number: 132438-14-3
• SMILES: [C@H]1([C@@H](C)[C@@H]1C(C)C)C[C@H]([C@@H]5[C@@]3([C@H]([C@@H]2CC=C4[C@@]([C@H]2CC3)(CC[C@H](O)C4)C)CC5)C)C
• InChI: 1S/C29H48O/c1-17(2)27-19(4)23(27)15-18(3)24-9-10-25-22-8-7-20-16-21(30)11-13-28(20,5)26(22)12-14-29(24,25)6/h7,17-19,21-27,30H,8-16H2,1-6H3/t18-,19-,21+,22+,23-,24-,25+,26+,27+,28+,29-/m1/s1
• InChIKey: GOZWAAJAKSAXBZ-YNKWLIIASA-N

Properties

• Density: 1.015g/cm³ (Cal.)
• Boiling point: 501.501°C at 760 mmHg (Cal.)
• Flash point: 218.356°C (Cal.)