CAS: 1802-12-6 - Phytolaccagenin
Formula:C31H48O7
InChI:InChI=1S/C31H48O7/c1-26(25(37)38-6)11-13-31(24(35)36)14-12-29(4)18(19(31)15-26)7-8-22-27(2)16-20(33)23(34)28(3,17-32)21(27)9-10-30(22,29)5/h7,19-23,32-34H,8-17H2,1-6H3,(H,35,36)/t19-,20-,21+,22+,23-,26-,27-,28-,29+,30+,31-/m0/s1
InChI key:InChIKey=CYJWWQALTIKOAG-FLORRLIPSA-N
SMILES:O=C(O)C12CCC(C(=O)OC)(C)CC2C3=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC4(C)C3(C)CC1
- Synonyms:
- (2beta,3beta,4alpha,20beta)-29-Methyl 2,3,23-trihydroxyolean-12-ene-28,29-dioate
- 2,3,23-Trihydroxy-29-Methoxy-29-Oxoolean-12-En-28-Oic Acid
- Jaligonic acid 30-methyl ester
- NSC 116453
- Olean-12-ene-28,29-dioic acid, 2,3,23-trihydroxy-, 29-methyl ester, (2beta,3beta,4alpha,20beta)-
- Olean-12-ene-28,29-dioic acid, 2,3,23-trihydroxy-, 29-methyl ester, (2β,3β,4α,20β)-
- Olean-12-ene-28,30-dioic acid, 2β,3β,23-trihydroxy-, 30-methyl ester
- Phytolaccagenine
- Phytolaccagenin