(19alpha)-16-(Methoxycarbonyl)-4,19-Dimethyl-16,17-Didehydro-18-Oxayohimban-4-Ium
[CAS# 6801-41-8]

Identification

• Name: (19alpha)-16-(Methoxycarbonyl)-4,19-Dimethyl-16,17-Didehydro-18-Oxayohimban-4-Ium
• Molecular Formula: C₂₂H₂₇N₂O₃
• Molecular Weight: 367.46
• CAS Registry Number: 6801-41-8
• SMILES: COC(=O)\C3=C\O[C@@H](C)[C@H]4C[N+]5(C)CCc1c(nc2ccccc12)[C@@H]5C[C@H]34
• InChI: 1S/C22H27N2O3/c1-13-17-11-24(2)9-8-15-14-6-4-5-7-19(14)23-21(15)20(24)10-16(17)18(12-27-13)22(25)26-3/h4-7,12-13,16-17,20,23H,8-11H2,1-3H3/q+1/t13-,16-,17+,20-,24?/m0/s1
• InChIKey: PGWDPYAZSCNZHS-OXIZCCONSA-N