genistin

Chemical Formula:

C₂₁H₂₀O₁₀

Molecular Weight:

432.383 Daltons

Monoisotopic Mass:

432.10564686299995 Daltons

SMILES:

C(O)C4(C(O)C(O)C(O)C(OC3(=CC2(OC=C(C1(C=CC(O)=CC=1))C(=O)C=2C(O)=C3)))O4)

InChI:

1S/C21H20O10/c22-7-15-18(26)19(27)20(28)21(31-15)30-11-5-13(24)16-14(6-11)29-8-12(17(16)25)9-1-3-10(23)4-2-9/h1-6,8,15,18-24,26-28H,7H2/t15-,18-,19+,20-,21-/m1/s1

InChIKey:

ZCOLJUOHXJRHDI-CMWLGVBASA-N

Synonyms

genistein 7-O-glucoside

Databases

MetaCyc: CPD-3421

ChEBI: 27514

PubChem (CID): 5281377

HMDB: HMDB33988

ChemSpider: 19265428

KEGG: C09126

MetaNetX: MNXM3602