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Chemical structure of Broussochalcone A

GC70853

Broussochalcone A

Also known as (E)-1-[2,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-3-(3,4-dihydroxyphenyl)prop-2-en-1-one

Broussochalcone A is an antioxidant and an inhibitor of Xanthine Oxidase (IC50=2·21 μM), with free radical scavenging activity

ChemicalCAS99217-68-2MW340.37FormulaC20H20O5
CAS number
99217-68-2
Molecular weight
340.37
Formula
C20H20O5
Solubility
DMSO : 100 mg/mL (293·80 mM; Need ultrasonic; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)
InChIKey
FEALTYYKRMRXTG-QPJJXVBHSA-N
Catalogue number
GC70853
Brand
GLPBIO
Computed properties PubChem CID 6438825 · XLogP 4.7 · TPSA 98 Ų · H-bond donors 4
XLogP
4.7
TPSA
98 Ų
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
25

SMILES CC(=CCC1=CC(=C(C=C1O)O)C(=O)/C=C/C2=CC(=C(C=C2)O)O)C

Computed descriptors from PubChem (CID 6438825), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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