Phyto4Health

Gossypetin

Representations & DB's id
ChEBI: CHEBI:16400
ChEMBL: CHEMBL253570
PubChem: 5280647
IUPAC: 2-(3,4-dihydroxyphenyl)-3,5,7,8-tetrahydroxychromen-4-one
Standard InChI: InChI=1S/C15H10O8/c16-6-2-1-5(3-7(6)17)14-13(22)12(21)10-8(18)4-9(19)11(20)15(10)23-14/h1-4,16-20,22H
Standard InChI Key: YRRAGUMVDQQZIY-UHFFFAOYSA-N
SMILES: Oc1cc(ccc1O)c1oc2c(O)c(O)cc(c2c(=O)c1O)O

Molecular propeties
AlogP: 1.69
Hydrogen bonds acceptors: 8
Hydrogen bonds donors: 6
Rotatable bonds: 1
Number of rings: 3
Molecular Weight: 318.04
Topological polar surface area: 148
Number of aromatic rings: 3
Fsp3: 0
Number of carbons: 15

Plant sources

Part of plant Plant name Ref.
PlantRhodiola rosea

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
IC5011000 nMCytochrome P450 19A1P11511
Potency2818.4 nMLysine-specific demethylase 4D-likeB2RXH2
Potency501.2 nMDNA-(apurinic or apyrimidinic site) lyaseP27695
Potency3548.1 nMMicrotubule-associated protein tauP10636
Potency35481.3 nMAldehyde dehydrogenase 1A1P00352
Potency3981.1 nMArachidonate 15-lipoxygenaseP16050
Potency7943.3 nMMicrotubule-associated protein tauP10636
Potency17782.8 nM15-hydroxyprostaglandin dehydrogenase [NAD+]P15428
Potency28183.8 nMAlpha-galactosidase AP06280
IC503000 nMBeta amyloid A4 proteinP05067
IC503000 nMMicrotubule-associated protein tauP10636
IC5087000 nMDeath-associated protein kinase 1P53355