956104-90-8 (21,23-环氧替鲁考-7-烯-3,21,24,25-四醇;(3β,21S,23R,24S)-,3-酮,21-甲基醚,21,23-Epoxytirucall-7-ene-3,21,24,25-tetrol; (3β,21S,23R,24S)-form, 3-Ketone, 21-Me ether)

CAS号:
956104-90-8
中文名称:
21,23-环氧替鲁考-7-烯-3,21,24,25-四醇;(3β,21S,23R,24S)-,3-酮,21-甲基醚
英文名称:
21,23-Epoxytirucall-7-ene-3,21,24,25-tetrol; (3β,21S,23R,24S)-form, 3-Ketone, 21-Me ether
分子式:
C31H50O5
分子量:
502.725710391998
植物源:

21,23-环氧替鲁考-7-烯-3,21,24,25-四醇;(3β,21S,23R,24S)-,3-酮,21-甲基醚(956104-90-8)名称与标识符

标识符

InChIKey:
NYUZBOBAGWNMHW-UHFFFAOYSA-N
Inchi:
1S/C31H50O5/c1-27(2)23-10-9-21-20(29(23,5)14-13-24(27)32)12-16-30(6)19(11-15-31(21,30)7)18-17-22(36-26(18)35-8)25(33)28(3,4)34/h9,18-20,22-23,25-26,33-34H,10-17H2,1-8H3
SMILES:
COC1C(C2C3(C(C4C(CC3)C3(C(C(C(CC3)=O)(C)C)CC=4)C)(C)CC2)C)CC(C(C(O)(C)C)O)O1