CHEBI:64361 - β-sesquiphellandrene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name β-sesquiphellandrene
ChEBI ASCII Name beta-sesquiphellandrene
Definition A sesquiterpene that is cyclohexene in which the hydrogens at position 6 are replaced by a methylidene group and in which the pro-R hydrogen at position 3 is replaced by a (2S)-6-methylhept-5-en-2-yl group.
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 204.18780
InChI InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8,10,14-15H,3,5,7,9,11H2,1-2,4H3/t14-,15+/m0/s1
SMILES [H][C@@]1(CCC(=C)C=C1)[C@@H](C)CCC=C(C)C
Metabolite of Species Details
Zingiber officinale (NCBI:txid94328) Found in rhizome (BTO:0001181). Dried rhizomes See: PubMed
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing β-sesquiphellandrene (CHEBI:64361) has role plant metabolite (CHEBI:76924)
β-sesquiphellandrene (CHEBI:64361) is a alicyclic compound (CHEBI:33654)
β-sesquiphellandrene (CHEBI:64361) is a sesquiterpene (CHEBI:35189)
Synonyms Sources
(−)-(6R,7S)-sesquiphellandrene ChEBI
(−)-β-sesquiphellandrene ChEBI
(-)-beta-Sesquiphellandrene KEGG COMPOUND
(R)-3-methylene-6-[(S)-6-methylhept-5-en-2-yl]-cyclohex-1-ene ChEBI
beta-sesquiphellandrene SUBMITTER
β-sesquiphellandrene UniProt
Manual Xrefs Databases
C00007630 KNApSAcK
CPD-8247 MetaCyc
View more database links
Registry Numbers Types Sources
20307-83-9 CAS Registry Number KEGG COMPOUND
20307-83-9 CAS Registry Number ChemIDplus
2554167 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
21880075 PubMed citation SUBMITTER
8064299 PubMed citation Europe PMC
Last Modified
25 March 2015
General Comment
2012-04-10 Needed for the reaction (2E,6E)-farnesyl diphosphate = β-sesquiphellandrene + diphosphate