Description
Wilforlide A acetate is a natural compound isolated from the herbs of Tripterygium wilfordii Hook.f.
Synonyms
Olean-12-en-29-oic acid, 3-(acetyloxy)-22-hydroxy-, g-lactone, (3b,20a,22a)-;Olean-12-en-29-oic acid, 3-(acetyloxy)-22-hydroxy-, γ-lactone, (3β,20α,22α)- (9CI)
Molecular Formula
C32H48O4
Canonical SMILES
CC(=O)OC1CCC2(C(C1(C)C)CCC3(C2CC=C4C3(CCC5(C4CC6(CC5OC6=O)C)C)C)C)C
InChI
InChI=1S/C32H48O4/c1-19(33)35-24-12-13-30(6)22(27(24,2)3)11-14-32(8)23(30)10-9-20-21-17-28(4)18-25(36-26(28)34)29(21,5)15-16-31(20,32)7/h9,21-25H,10-18H2,1-8H3/t21-,22-,23+,24-,25-,28-,29+,30-,31+,32+/m0/s1
InChIKey
KCKCIDCRXAOGCM-KXWOPETLSA-N