Phyto4Health

Techtochrysin

Representations & DB's id
ChEBI: CHEBI:9426
ChEMBL: CHEMBL164841
PubChem: 5281954
IUPAC: 5-hydroxy-7-methoxy-2-phenylchromen-4-one
Standard InChI: InChI=1S/C16H12O4/c1-19-11-7-12(17)16-13(18)9-14(20-15(16)8-11)10-5-3-2-4-6-10/h2-9,17H,1H3
Standard InChI Key: IRZVHDLBAYNPCT-UHFFFAOYSA-N
SMILES: COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1

Molecular propeties
AlogP: 3.17
Hydrogen bonds acceptors: 4
Hydrogen bonds donors: 1
Rotatable bonds: 2
Number of rings: 3
Molecular Weight: 268.07
Topological polar surface area: 55.8
Number of aromatic rings: 3
Fsp3: 0.062
Number of carbons: 16

Plant sources

Part of plant Plant name Ref.
PlantGratiola officinalis
PlantSenecio platyphylloides
PlantCotinus coggygria
PlantAnacyclus pyrethrum

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Potency31622.8 nMThyroid stimulating hormone receptorP16473
Potency398.1 nMCytochrome P450 2C19P33261
Potency1122 nMMicrotubule-associated protein tauP10636
Potency4466.8 nMMicrotubule-associated protein tauP10636
Potency5623.4 nMNiemann-Pick C1 proteinO15118
Potency10000 nMCytochrome P450 3A4P08684
Potency2511.9 nMCytochrome P450 2C9P11712
Potency10000 nMCytochrome P450 3A4P08684
Potency28183.8 nMBeta-glucocerebrosidaseP04062
Potency23099.9 nMATPase family AAA domain-containing protein 5Q96QE3
Potency16353.5 nMATPase family AAA domain-containing protein 5Q96QE3
Potency4.6 nMGemininO75496
Potency35481.3 nMNuclear factor erythroid 2-related factor 2Q16236