26-p-E-Coumaryloxy-ursolic acid

Molecular Formula: C39H54O6


InChI: InChI=1/C39H54O6/c1-24-15-20-38(34(43)44)21-22-39(23-45-32(42)14-9-26-7-10-27(40)11-8-26)28(33(38)25(24)2)12-13-30-36(5)18-17-31(41)35(3,4)29(36)16-19-37(30,39)6/h7-12,14,24-25,29-31,33,40-41H,13,15-23H2,1-6H3,(H,43,44)/b14-9+/t24-,25+,29u,30u,31+,33+,36+,37-,38+,39u/m1/s1/f/h43H

InChIKey: InChIKey=RZHJGXXCTIXCRI-HGOOVQACDZ
SMILES: CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)COC(=O)C=CC6=CC=C(C=C6)O)C(=O)O

Names:
    NSC640471
    (1S,2R,4aS,6bR,10S,12aS,14bR)-10-hydroxy-6a-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]-1,2,6b,9,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
    26-p-E-Coumaryloxy-ursolic acid

Registries:
    PubChem CID 5459190
    PubChem ID 8142244