3-C-glucosyl-2,4,4',6-tetrahydroxydibenzoylmethane

Chemical Formula:

C₂₁H₂₁O₁₁

Molecular Weight:

449.39 Daltons

Monoisotopic Mass:

450.11621154930003 Daltons

SMILES:

C1(=CC(O)=CC=C1C(=O)CC(=O)C3(=C(O)C=C([O-])C(C2(C(C(C(O)C(O2)CO)O)O))=C(O)3))

InChI:

1S/C21H22O11/c22-7-14-17(28)19(30)20(31)21(32-14)16-13(27)6-12(26)15(18(16)29)11(25)5-10(24)8-1-3-9(23)4-2-8/h1-4,6,14,17,19-23,26-31H,5,7H2/p-1/t14-,17-,19+,20-,21+/m1/s1

InChIKey:

GCEHZSFCBPUADZ-VJXVFPJBSA-M

Databases

MetaCyc: CPD-15088

PubChem (CID): 90657396 90657395

ChEBI: 136786