Phyto4Health

Cyclohexanone

Representations & DB's id

ChEBI: CHEBI:17854
ChEMBL: CHEMBL18850
PubChem: 7967
IUPAC: cyclohexanone
Standard InChI: InChI=1S/C6H10O/c7-6-4-2-1-3-5-6/h1-5H2
Standard InChI Key: JHIVVAPYMSGYDF-UHFFFAOYSA-N
SMILES: O=C1CCCCC1

Molecular propeties

AlogP: 1.52
Hydrogen bonds acceptors: 1
Hydrogen bonds donors: 0
Rotatable bonds: 0
Number of rings: 1
Molecular Weight: 98.07
Topological polar surface area: 17.1
Number of aromatic rings: 0
Fsp3: 0.833
Number of carbons: 6

Plant sources

Part of plant Plant name Ref.
PlantCrocus sativus

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Potency35481.3 nMAldehyde dehydrogenase 1A1P00352
Potency1458.1 nMGemininO75496