Products 71385-83-6

CAS 71385-83-6 appears in our catalog under these names: 6'–O–Acetyldaidzin, 6-O-Acetyldaidzin, 6''''-O-Acetyldaidzin, Daidzin 6''-O-Acetate, "6""-O-Acetyldaidzin, 99.89%". Offered by: GLPBio, Biosynth, Chemat, TRC, MedChemExpress. Available pack sizes: 1mg, 5mg, 2mg, 10mg, 25mg, 100mg, 1 mg, 5 mg.

Structural formula: {0} (CAS {1})

Daidzein 7-(6-O-acetyl-beta-D-glucoside) is a glycosyloxyisoflavone that is daidzein in which the phenolic hydrogen at position 7 has been replaced by a 6-O-acetyl-beta-D-glucosyl residue. It has a role as a plant metabolite and a human xenobiotic metabolite. It is a beta-D-glucoside, a member of phenols, a hydroxyisoflavone, an acetate ester, an O-acyl carbohydrate, a monosaccharide derivative and a glycosyloxyisoflavone. It is functionally related to a daidzein.

Source: ChEBI

Identity
Molecular formulaC23H22O10
Molecular weight458.4 g/mol
IUPAC name[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methyl acetate
InChIKeyZMOZJTDOTOZVRT-DODNOZFWSA-N
SMILESCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=C(C=C4)O)O)O)O

Computed by PubChem (NCBI)