Fisetin
2-(3,4-dihydroxyphenyl)-3,7-dihydroxychromen-4-one
Molecular Identity
Fisetin
2-(3,4-dihydroxyphenyl)-3,7-dihydroxychromen-4-one
PubChem CID: 5281614
Fisetin is a 7-hydroxyflavonol with additional hydroxy groups at positions 3, 3' and 4'. It has a role as a geroprotector, an antioxidant, a metabolite, an EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor, an anti-inflammatory agent and a plant metabolite. It is a 3'-hydroxyflavonoid, a tetrahydroxyflavone and a 7-hydroxyflavonol. It is a conjugate acid of a fisetin(1-).
2D Structure
Properties
C15H10O6
Molecular Formula
286.24
Molecular Weight
g/mol
286.0477
Exact Mass
Da
2
XLogP
Drug-like (Lipinski: < 5)
107
TPSA
Good oral absorption (< 140 A²)
4
H-Bond Donors
6
H-Bond Acceptors
459
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Fisetin528-48-32-(3,4-Dihydroxyphenyl)-3,7-dihydroxy-4H-chromen-4-one5-Desoxyquercetin3,3',4',7-Tetrahydroxyflavone3,7,3',4'-TetrahydroxyflavoneFustelVisetFisetholzSuperfustelCotininFietinFustetJunger fustikC.I. Natural Brown 1
Data from PubChem (NCBI)
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