(8S,9S,10R,13S,14S,17S)-17-[(1R)-1-Hydroxyprop-2-Ynyl]-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[a]Phenanthren-3-One
[CAS# 72012-08-9]

Identification

• Name: (8S,9S,10R,13S,14S,17S)-17-[(1R)-1-Hydroxyprop-2-Ynyl]-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[a]Phenanthren-3-One
• Synonyms: 17-Hpao; 17Beta-((1R)-1-Hydroxy-2-Propynyl)Androst-4-En-3-One; Androst-4-En-3-One, 17-(1-Hydroxy-2-Propynyl)-, (17Beta(R))-
• Molecular Formula: C₂₂H₃₀O₂
• Molecular Weight: 326.48
• CAS Registry Number: 72012-08-9
• SMILES: [C@H]34[C@H]2[C@@H]([C@@]1(C(=CC(=O)CC1)CC2)C)CC[C@@]3([C@H](CC4)[C@@H](O)C#C)C
• InChI: 1S/C22H30O2/c1-4-20(24)19-8-7-17-16-6-5-14-13-15(23)9-11-21(14,2)18(16)10-12-22(17,19)3/h1,13,16-20,24H,5-12H2,2-3H3/t16-,17-,18-,19+,20-,21-,22-/m0/s1
• InChIKey: IVINXMJXYQJLGF-ZXYIWLIBSA-N