alpha-Elemolic acid

Molecular Formula: C30H48O3


InChI: InChI=1/C30H48O3/c1-19(2)9-8-10-20(26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h9,20-21,24-25,31H,8,10-18H2,1-7H3,(H,32,33)/t20-,21-,24-,25+,28+,29-,30+/m0/s1/f/h32H

InChIKey: InChIKey=NBSBUIQBEPROBM-DASWPDOJDX
SMILES: CC(=CCCC(C1CCC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)O)C)C)C)C(=O)O)C

Names:
    alpha-Elemolic acid
    C08623
    (2S)-2-[(3R,5S,10S,13S,14S,17S)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-hept-5-enoic acid
    28282-27-1

Registries:
    PubChem CID 441677
    PubChem ID 10816