Phyto4Health

2-Methyl-5-Prop-1-En-2-Ylcyclohex-2-En-1-Ol

Representations & DB's id

ChEBI: CHEBI:23046
ChEMBL: CHEMBL1385229
PubChem: 7438
IUPAC: 2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ol
Standard InChI: InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-11H,1,5-6H2,2-3H3
Standard InChI Key: BAVONGHXFVOKBV-UHFFFAOYSA-N
SMILES: CC(=C)C1CC=C(C(C1)O)C

Molecular propeties

AlogP: 2.28
Hydrogen bonds acceptors: 1
Hydrogen bonds donors: 1
Rotatable bonds: 1
Number of rings: 1
Molecular Weight: 152.12
Topological polar surface area: 20.2
Number of aromatic rings: 0
Fsp3: 0.6
Number of carbons: 10

Plant sources

Part of plant Plant name Ref.
PlantCitrus unshiu

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Potency79.4 nMThyroid stimulating hormone receptorP16473
Potency79.4 nMThyroid stimulating hormone receptorP16473
Potency7.9 nMCellular tumor antigen p53P04637