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Chemical structure of 3',4',7-Trihydroxyisoflavone

GC40618

3',4',7-Trihydroxyisoflavone

Also known as 3-(3,4-dihydroxyphenyl)-7-hydroxychromen-4-one

3',4',7-Trihydroxyisoflavone, a major metabolite of Daidzein, is an ATP-competitive inhibitor of Cot (Tpl2/MAP3K8) and MKK4· 3',4',7-Trihydroxyisoflavone has anticancer, anti-angiogenic, chemoprotective, and free radical scavenging activities

ChemicalCAS485-63-2MW270.2FormulaC15H10O5
CAS number
485-63-2
Molecular weight
270.2
Formula
C15H10O5
Solubility
DMF： 20 mg/ml,DMF：PBS (pH 7·2) (1：4)： 0·1 mg/ml,DMSO： 10 mg/ml,Ethanol： 1 mg/ml
InChIKey
DDKGKOOLFLYZDL-UHFFFAOYSA-N
Catalogue number
GC40618
Brand
GLPBIO
Computed properties PubChem CID 5284648 · XLogP 2.1 · TPSA 87 Ų · H-bond donors 3
XLogP
2.1
TPSA
87 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
20

SMILES C1=CC(=C(C=C1C2=COC3=C(C2=O)C=CC(=C3)O)O)O

Computed descriptors from PubChem (CID 5284648), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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