Phyto4Health

(S)(+)Carvone

Representations & DB's id

ChEBI: CHEBI:15399
ChEMBL: CHEMBL501949
PubChem: 16724
IUPAC: (5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-one
Standard InChI: InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9H,1,5-6H2,2-3H3/t9-/m0/s1
Standard InChI Key: ULDHMXUKGWMISQ-VIFPVBQESA-N
SMILES: CC(=C)[C@H]1CC=C(C(=O)C1)C

Molecular propeties

AlogP: 2.49
Hydrogen bonds acceptors: 1
Hydrogen bonds donors: 0
Rotatable bonds: 1
Number of rings: 1
Molecular Weight: 150.1
Topological polar surface area: 17.1
Number of aromatic rings: 0
Fsp3: 0.5
Number of carbons: 10

Plant sources

Part of plant Plant name Ref.
PlantHypericum perforatum
PlantCitrus unshiu
PlantJuniperus oxycedrus
PlantMentha spicata
PlantMentha spicata
PlantThymus vulgaris
PlantCarum carvi
PlantCarum carvi
PlantCarum carvi
PlantAnethum graveolens
PlantAnethum graveolens
PlantAnethum graveolens
PlantAnethum graveolens
PlantFoeniculum vulgare

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Potency28183.8 nMAldehyde dehydrogenase 1A1P00352
Potency22387.2 nMAldehyde dehydrogenase 1A1P00352
Potency18833.6 nMNuclear factor erythroid 2-related factor 2Q16236
Potency59.6 nMNuclear receptor ROR-gammaP51449