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CHEBI:62760 - (−)-β-curcumene

Default Structure
ChEBI IDCHEBI:62760
ChEBI Name(−)-β-curcumene
Stars
ASCII Name(-)-beta-curcumene
DefinitionA β-curcumene that has R configuration at the chiral centre.
Last Modified25 March 2015
SubmitterGareth Owen
DownloadsMolfile
FormulaC15H24
Net Charge0
Average Mass204.357
Monoisotopic Mass204.18780
SMILESCC(C)=CCC[C@@H](C)C1=CCC(C)=CC1
InChIInChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8,11,14H,5,7,9-10H2,1-4H3/t14-/m1/s1
InChIKeyJXZQZARENYGJMK-CQSZACIVSA-N
Roles Classification
Biological Role:
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)
(−)-β-curcumene (CHEBI:62760) has role plant metabolite (CHEBI:76924)
(−)-β-curcumene (CHEBI:62760) is a β-curcumene (CHEBI:62759)
IUPAC Name 
1-methyl-4-[(2R)-6-methylhept-5-en-2-yl]cyclohexa-1,4-diene
Synonym  Source
β-curcumeneChEBI
UniProt Name  Source
(−)-β-curcumeneUniProt
Manual XrefsDatabases
C00011630KNApSAcK
CPD-11392MetaCyc
Registry NumbersSources
Reaxys:5791054Reaxys
CAS:28976-67-2Reaxys
Citations