70031-41-3 (3-(5,18-seco-ibogamin-13-基)-vobasan-17-油酸甲酯,3-(5,18-seco-ibogamin-13-yl)-vobasan-17-oic acid methyl ester)

CAS号:
70031-41-3
中文名称:
3-(5,18-seco-ibogamin-13-基)-vobasan-17-油酸甲酯
英文名称:
3-(5,18-seco-ibogamin-13-yl)-vobasan-17-oic acid methyl ester
分子式:
C40H50N4O2
分子量:
618.850610256195

3-(5,18-seco-ibogamin-13-基)-vobasan-17-油酸甲酯(70031-41-3)名称与标识符

名称

英文别名:
3-(5,18-seco-ibogamin-13-yl)-vobasan-17-oic acid methyl ester;Deshydroxycapuvosine;

标识符

InChIKey:
RSFQWUFIKSSDIJ-RROVHIOVSA-N
Inchi:
1S/C40H50N4O2/c1-5-24-17-25-11-14-35-30(15-16-44(21-24)22-25)29-13-12-27(18-36(29)41-35)32-19-31-26(6-2)23-43(3)37(38(31)40(45)46-4)20-33-28-9-7-8-10-34(28)42-39(32)33/h6-10,12-13,18,24-25,31-32,37-38,41-42H,5,11,14-17,19-23H2,1-4H3/b26-6-
SMILES:
CCC1CN2CCC3C4C(=CC(C5C6NC7C(C=6CC6N(C/C(/C(C6C(OC)=O)C5)=C/C)C)=CC=CC=7)=CC=4)NC=3CCC(C2)C1