daidzin

Chemical Formula:

C₂₁H₂₀O₉

Molecular Weight:

416.384 Daltons

Monoisotopic Mass:

416.1107322409 Daltons

SMILES:

C(C1(OC(C(O)C(O)C1O)OC2(C=CC3(=C(C=2)OC=C(C3=O)C4(C=CC(=CC=4)O)))))O

InChI:

1S/C21H20O9/c22-8-16-18(25)19(26)20(27)21(30-16)29-12-5-6-13-15(7-12)28-9-14(17(13)24)10-1-3-11(23)4-2-10/h1-7,9,16,18-23,25-27H,8H2/t16-,18-,19+,20-,21-/m1/s1

InChIKey:

KYQZWONCHDNPDP-QNDFHXLGSA-N

Synonyms

daidzein 7-O-β-D-glucoside

Databases

MetaCyc: CPD-3424

PubChem (CID): 107971

MetaboLights: MTBLC42202

HMDB: HMDB33991

DRUGBANK: DB02115

ChemSpider: 10164919

ChEBI: 42202

KEGG: C10216

RefMet: Daidzin

Seed: cpd07105

MetaNetX: MNXM3575