17-Hydroxy-20-Yohimban-16-(N-(4-Azido-3-Iodo)Phenyl)Carboxamide
[CAS# 108206-16-2]

Identification

• Name: 17-Hydroxy-20-Yohimban-16-(N-(4-Azido-3-Iodo)Phenyl)Carboxamide
• Synonyms: Rau-Azpc
• Molecular Formula: C₂₆H₂₇IN₆O₂
• Molecular Weight: 582.44
• CAS Registry Number: 108206-16-2
• SMILES: [C@H]13C5=C(CCN1C[C@H]2CC[C@@H]([C@H]([C@H]2C3)C(=O)NC4=CC(=C(C=C4)N=[N+]=[N-])[125I])O)C6=C([NH]5)C=CC=C6
• InChI: 1S/C26H27IN6O2/c27-19-11-15(6-7-21(19)31-32-28)29-26(35)24-18-12-22-25-17(16-3-1-2-4-20(16)30-25)9-10-33(22)13-14(18)5-8-23(24)34/h1-4,6-7,11,14,18,22-24,30,34H,5,8-10,12-13H2,(H,29,35)/t14-,18+,22+,23+,24+/m1/s1/i27-2
• InChIKey: OIJUJHQUYGBPNM-NCNAYSDWSA-N