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Accession Number:
pdtdbl00213
Details of the Ligand
Ligand Name :
alpha-Selinene
Systematic Names :
alpha-Selinene; a-Selinene; (-)-alpha-Selinene
Molecular Formula :
C
15
H
24
Molecular Weight :
g/mol
IUPAC Name :
4a,8-dimethyl-2-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,8a-octahydronaphthalene
Canonical SMILES :
CC(=C)C1CCC2(C)CCC=C(C)C2C1
Ligand Description :
α-Selinene is found in alcoholic beverages. α-Selinene occurs in celery oil and hop (
Humulus lupulus
) oil. α-Selinene belongs to the family of Sesquiterpenes. These are terpenes with three consecutive isoprene units.
Related Plants :
Black Pepper
,
Long Pepper
Ligand Related Dockings :
NA
Ligand References :
http://www.hmdb.ca/metabolites/HMDB35810
http://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:59961
http://eng.tradimed.com/eChemInfo.asp?cid=1840&tox=
http://www.chemspider.com/Chemical-Structure.9031905.html
Click the image to enlarge