Phyto4Health

7-Methoxy-2-Methyl-3-Phenylchromen-4-One

Representations & DB's id

ChEBI: None
ChEMBL: CHEMBL1322285
PubChem: 354368
IUPAC: 7-methoxy-2-methyl-3-phenylchromen-4-one
Standard InChI: InChI=1S/C17H14O3/c1-11-16(12-6-4-3-5-7-12)17(18)14-9-8-13(19-2)10-15(14)20-11/h3-10H,1-2H3
Standard InChI Key: XRGWZIGGCNSFRY-UHFFFAOYSA-N
SMILES: COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

Molecular propeties

AlogP: 3.78
Hydrogen bonds acceptors: 3
Hydrogen bonds donors: 0
Rotatable bonds: 2
Number of rings: 3
Molecular Weight: 266.09
Topological polar surface area: 35.5
Number of aromatic rings: 3
Fsp3: 0.118
Number of carbons: 17

Plant sources

Part of plant Plant name Ref.
PlantGlycyrrhiza glabra

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Potency15848.9 nMAldehyde dehydrogenase 1A1P00352
Potency50118.7 nMCellular tumor antigen p53P04637
Potency20596.2 nMATPase family AAA domain-containing protein 5Q96QE3
Potency23109.3 nMATPase family AAA domain-containing protein 5Q96QE3
Potency12589.3 nMBreast cancer type 1 susceptibility proteinP38398