Phyto4Health

P-Cresol

Representations & DB's id

ChEBI: CHEBI:17847
ChEMBL: CHEMBL16645
PubChem: 2879
IUPAC: 4-methylphenol
Standard InChI: InChI=1S/C7H8O/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H3
Standard InChI Key: IWDCLRJOBJJRNH-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1)O

Molecular propeties

AlogP: 1.7
Hydrogen bonds acceptors: 1
Hydrogen bonds donors: 1
Rotatable bonds: 0
Number of rings: 1
Molecular Weight: 108.06
Topological polar surface area: 20.2
Number of aromatic rings: 1
Fsp3: 0.143
Number of carbons: 7

Plant sources

Part of plant Plant name Ref.
PlantFagopyrum esculentum
PlantPimpinella anisum
PlantPimpinella anisum

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Others10 pm/min/mgUDP-glucuronosyltransferase 1-6P19224
Others200 pm/min/mgUDP-glucuronosyltransferase 1-6P19224
Others29 pm/min/mgUDP-glucuronosyltransferase 1-6P19224
Others150 pm/min/mgUDP-glucuronosyltransferase 1-9O60656
Potency47307.9 nMNuclear factor erythroid 2-related factor 2Q16236
Potency94391.8 nMInterleukin-8P10145
Potency10590.9 nMNuclear receptor ROR-gammaP51449