CHEBI:59961 - α-selinene

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ChEBI Name α-selinene
ChEBI ID CHEBI:59961
ChEBI ASCII Name alpha-selinene
Definition An isomer of selinene where the double bond in the octahydronaphthalene ring system is endocyclic (2R,4aR,8aR)-configuration..
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C15H24
Net Charge 0
Average Mass 204.35110
Monoisotopic Mass 204.188
InChI InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h6,13-14H,1,5,7-10H2,2-4H3/t13-,14+,15-/m1/s1
InChIKey OZQAPQSEYFAMCY-QLFBSQMISA-N
SMILES [H][C@]1(CC[C@@]2(C)CCC=C(C)[C@]2([H])C1)C(C)=C
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via selinene )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing α-selinene (CHEBI:59961) has role plant metabolite (CHEBI:76924)
α-selinene (CHEBI:59961) is a octahydronaphthalenes (CHEBI:138397)
α-selinene (CHEBI:59961) is a selinene (CHEBI:49272)
IUPAC Name
(2R,4aR,8aR)-4a,8-dimethyl-2-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,8a-octahydronaphthalene
Synonyms Sources
(2R-(2α,4aα,8aβ))-1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethenyl)naphthalene ChemIDplus
2-Isopropenyl-4a,8-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene NIST Chemistry WebBook
α-selinene UniProt
Eudesma-3,11-diene ChEBI
Manual Xrefs Databases
Alpha-selinene MetaCyc
HMDB0035810 HMDB
View more database links
Registry Numbers Types Sources
2501574 Beilstein Registry Number Beilstein
2501574 Reaxys Registry Number Reaxys
473-13-2 CAS Registry Number ChemIDplus
473-13-2 CAS Registry Number NIST Chemistry WebBook
Citation Waiting for Citations Type Source
15516500 PubMed citation SUBMITTER
Last Modified
07 September 2017