Biochanin A 7-O-(6-O-malonyl-beta-D-glucoside)

Molecular Formula: C24H22O12


InChI: InChI=1/C24H22O12/c25-14-6-12(7-15-19(14)20(29)13(9-33-15)11-4-2-1-3-5-11)35-24-23(32)22(31)21(30)16(36-24)10-34-18(28)8-17(26)27/h1-7,9,16,21-25,30-32H,8,10H2,(H,26,27)/t16-,21-,22+,23-,24-/m1/s1/f/h26H

InChIKey: InChIKey=USGHVUIXEILMSI-RMIQOMOADX
SMILES: C1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)OC4C(C(C(C(O4)COC(=O)CC(=O)O)O)O)O

Names:
    Biochanin A 7-O-(6-O-malonyl-beta-D-glucoside)
    CHEBI:28556
    3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(5-hydroxy-4-oxo-3-phenyl-chromen-7-yl)oxy-oxan-2-yl]methoxy]propanoic acid
    5-hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(carboxyacetyl)-beta-D-glucopyranoside
    6''-O-Malonyl-biochanin A-beta-D-glucoside

Registries:
    PubChem CID 5460012
    PubChem ID 8144319