(8S,9S,13S,14S)-17-(2-Bromoethynyl)-3,17-Dimethoxy-13-Methyl-7,8,9,11, 12,14,15,16-Octahydro-6H-Cyclopenta[a]Phenanthrene
[CAS# 7548-46-1]

Identification

• Name: (8S,9S,13S,14S)-17-(2-Bromoethynyl)-3,17-Dimethoxy-13-Methyl-7,8,9,11, 12,14,15,16-Octahydro-6H-Cyclopenta[a]Phenanthrene
• Synonyms: Brn 3002714; 19-Nor-17-Alpha-Pregna-1,3,5(10)-Trien-20-Yne, 21-Bromo-3,17-Dimethoxy-; 19-Norpregna-1,3,5(10)-Trien-20-Yne, 21-Bromo-3,17-Dimethoxy-, (17-Alpha)- (9Ci)
• Molecular Formula: C₂₂H₂₇BrO₂
• Molecular Weight: 403.36
• CAS Registry Number: 7548-46-1
• SMILES: [C@@H]23CCC1=C(C=CC(=C1)OC)[C@H]2CC[C@]4([C@H]3CCC4(C#CBr)OC)C
• InChI: 1S/C22H27BrO2/c1-21-10-8-18-17-7-5-16(24-2)14-15(17)4-6-19(18)20(21)9-11-22(21,25-3)12-13-23/h5,7,14,18-20H,4,6,8-11H2,1-3H3/t18-,19-,20+,21+,22?/m1/s1
• InChIKey: PAAJJNWRSCPYBM-RPKDUVEISA-N