Didesmethyl Mifepristone
[CAS# 104004-92-4]

Identification

• Name: Didesmethyl Mifepristone
• Synonyms: Estra-4,9-Dien-3-One, 11-(4-Aminophenyl)-17-Hydroxy-17-(1-Propynyl)-, (11Beta,17Beta)-; Ru 42848; Ru-42848
• Molecular Formula: C₂₇H₃₁NO₂
• Molecular Weight: 401.55
• CAS Registry Number: 104004-92-4
• SMILES: [C@H]13[C@@](C(O)(CC1)C#CC)(C[C@@H](C4=C2C(=CC(=O)CC2)CC[C@@H]34)C5=CC=C(N)C=C5)C
• InChI: 1S/C27H31NO2/c1-3-13-27(30)14-12-24-22-10-6-18-15-20(29)9-11-21(18)25(22)23(16-26(24,27)2)17-4-7-19(28)8-5-17/h4-5,7-8,15,22-24,30H,6,9-12,14,16,28H2,1-2H3/t22-,23+,24-,26-,27?/m0/s1
• InChIKey: MIPBCIAEOBOEKD-QHOBUDFZSA-N