Phyto4Health

Carvacrol

Representations & DB's id
ChEBI: CHEBI:3440
ChEMBL: CHEMBL281202
PubChem: 10364
IUPAC: 2-methyl-5-propan-2-ylphenol
Standard InChI: InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3
Standard InChI Key: RECUKUPTGUEGMW-UHFFFAOYSA-N
SMILES: CC(c1ccc(c(c1)O)C)C

Molecular propeties
AlogP: 2.82
Hydrogen bonds acceptors: 1
Hydrogen bonds donors: 1
Rotatable bonds: 1
Number of rings: 1
Molecular Weight: 150.1
Topological polar surface area: 20.2
Number of aromatic rings: 1
Fsp3: 0.4
Number of carbons: 10

Plant sources

Part of plant Plant name Ref.
ShootOriganum vulgare
ShootOriganum vulgare
ShootOriganum vulgare
PlantCoriandrum sativum
StigmaZea mays
StigmaZea mays
StigmaZea mays
PlantPrunus laurocerasus
ImmaturusCitrus unshiu
PlantPrunus persica
PlantVaccinium vitis-idaea
PlantSambucus nigra
Essential OilThymus vulgaris
PlantThymus vulgaris
ShootThymus vulgaris
Essential OilThymus vulgaris
PlantThymus vulgaris
ShootThymus vulgaris
Essential OilThymus vulgaris
PlantThymus vulgaris
ShootThymus vulgaris
Essential OilThymus vulgaris
PlantThymus vulgaris
ShootThymus vulgaris
Seed Essent. OilAnethum graveolens
LeafAnethum graveolens
PlantAnethum graveolens
FructusFoeniculum vulgare
PlantSalvia officinalis

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
EC507000 nMTransient receptor potential cation channel subfamily A member 1O75762
Others17 pm/min/mgUDP-glucuronosyltransferase 1-1P22309
Others0 pm/min/mgUDP-glucuronosyltransferase 1-1P22309
Others0 pm/min/mgUDP-glucuronosyltransferase 1-10Q9HAW8
Others30 pm/min/mgUDP-glucuronosyltransferase 1A4P22310
Others400 pm/min/mgUDP-glucuronosyltransferase 1-6P19224
Others0 pm/min/mgUDP-glucuronosyltransferase 1-6P19224
Others744 pm/min/mgUDP-glucuronosyltransferase 1-8Q9HAW9
Others2700 pm/min/mgUDP-glucuronosyltransferase 1-9O60656
Others0 pm/min/mgUDP-glucuronosyltransferase 2A1Q9Y4X1
Others3 pm/min/mgUDP-glucuronosyltransferase 2B15P54855