Products 34232-17-2

CAS 34232-17-2 appears in our catalog under these names: Sissotrin 6''-O-malonate, Biochanin A 7-O-beta-D-glucoside 6''-O-malonate, Biochanin A 7-O-glucoside 6''-O-malonate. Offered by: Chemat Brand, TRC, Biosynth. Available pack sizes: on request, 100mg, 5mg, 1mg, 10mg.

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

Biochanin A 7-O-(6-O-malonyl-beta-D-glucoside) is a glycosyloxyisoflavone that is biochanin A 7-O-beta-D-glucoside in which the hydroxy group at position 6 of the glucosyl moiety has been acylated by one of the carboxy groups of malonic acid. It is a member of 4'-methoxyisoflavones, a beta-D-glucoside and a glycosyloxyisoflavone. It is functionally related to a biochanin A. It is a conjugate acid of a biochanin A 7-O-beta-D-glucoside 6''-O-malonate.

Source: ChEBI

Identity
Molecular formulaC25H24O13
Molecular weight532.4 g/mol
IUPAC name3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-3-(4-methoxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]propanoic acid
InChIKeyVRCBYTZZZFFKEN-RBZNUJCTSA-N
SMILESCOC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COC(=O)CC(=O)O)O)O)O

Computed by PubChem (NCBI)