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Chemical structure of 4''-methyloxy-Genistin

GC35141

4''-methyloxy-Genistin

Also known as 7-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-5-hydroxy-3-(4-hydroxyphenyl)chromen-4-one

4''-methyloxy-Genistin, an isoflavone methyl-glycoside, is isolated from Cordyceps militaris grown on germinated soybeans

ChemicalCAS950910-16-4MW446.4FormulaC22H22O10
CAS number
950910-16-4
Molecular weight
446.4
Formula
C22H22O10
Solubility
Soluble in DMSO
InChIKey
DQFZFJHZGAOITN-YCDQRNBNSA-N
Catalogue number
GC35141
Brand
GLPBIO
Computed properties PubChem CID 71621984 · XLogP 0.8 · TPSA 155 Ų · H-bond donors 5
XLogP
0.8
TPSA
155 Ų
H-bond donors
5
H-bond acceptors
10
Rotatable bonds
5
Heavy atoms
32

SMILES CO[C@@H]1[C@H](O[C@H]([C@@H]([C@H]1O)O)OC2=CC(=C3C(=C2)OC=C(C3=O)C4=CC=C(C=C4)O)O)CO

Computed descriptors from PubChem (CID 71621984), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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