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CHEBI:10418 - trans-β-farnesene

ChEBI IDCHEBI:10418
ChEBI Nametrans-β-farnesene
Stars
ASCII Nametrans-beta-farnesene
DefinitionA β-farnesene in which the double bond at position 6-7 has E configuration. It is the major or sole alarm pheromone in most species of aphid.
Last Modified30 October 2017
DownloadsMolfile
FormulaC15H24
Net Charge0
Average Mass204.357
Monoisotopic Mass204.18780
SMILESC=CC(=C)CC/C=C(\C)CCC=C(C)C
InChIInChI=1S/C15H24/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9,12H,1,4,7-8,10-11H2,2-3,5H3/b15-12+
InChIKeyJSNRRGGBADWTMC-NTCAYCPXSA-N
Roles Classification
Biological Roles:
alarm pheromone  A pheromone which is released by an organism when damaged by a predator which warns other individuals that there is a danger.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
trans-β-farnesene (CHEBI:10418) has role alarm pheromone (CHEBI:72575)
trans-β-farnesene (CHEBI:10418) has role metabolite (CHEBI:25212)
trans-β-farnesene (CHEBI:10418) is a β-farnesene (CHEBI:39241)
Incoming Relation(s)
β-geranylfarnesene (CHEBI:138226) has functional parent trans-β-farnesene (CHEBI:10418)
β-heptaprene (CHEBI:138228) has functional parent trans-β-farnesene (CHEBI:10418)
β-hexaprene (CHEBI:138227) has functional parent trans-β-farnesene (CHEBI:10418)
IUPAC Name 
(6E)-7,11-dimethyl-3-methylenedodeca-1,6,10-triene
Synonyms  Source
(6E)-7,11-dimethyl-3-methylene-1,6,10-dodecatrieneNIST Chemistry WebBook
beta-FarneseneKEGG COMPOUND
(E)-7,11-dimethyl-3-methylenedodeca-1,6,10-trieneChemIDplus
(E)-β-farneseneNIST Chemistry WebBook
trans-7,11-dimethyl-3-methylene-1,6,10-dodecatrieneChEBI
trans-β-farneseneNIST Chemistry WebBook
UniProt Name  Source
(E)-β-farneseneUniProt
Manual XrefsDatabases
1386BPDB
C00003131KNApSAcK
C09666KEGG COMPOUND
CPD-8239MetaCyc
HMDB0035913HMDB
Registry NumbersSources
Reaxys:1721510Reaxys
CAS:18794-84-8KEGG COMPOUND
CAS:18794-84-8NIST Chemistry WebBook
CAS:18794-84-8ChemIDplus
Citations