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CHEBI:63701 - (−)-α-cuprenene

Default Structure
ChEBI IDCHEBI:63701
ChEBI Name(−)-α-cuprenene
Stars
ASCII Name(-)-alpha-cuprenene
DefinitionA sesquiterpene that consists of cyclohexa-1,3-diene bearing a methyl substituent at position 1 and an (S)-1,2,2-trimethylcyclopent-1-yl group at position 4.
Last Modified25 March 2015
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC15H24
Net Charge0
Average Mass204.357
Monoisotopic Mass204.18780
SMILESCC1=CC=C([C@@]2(C)CCCC2(C)C)CC1
InChIInChI=1S/C15H24/c1-12-6-8-13(9-7-12)15(4)11-5-10-14(15,2)3/h6,8H,5,7,9-11H2,1-4H3/t15-/m1/s1
InChIKeyDYQFFTPJVWEYMH-OAHLLOKOSA-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)
(−)-α-cuprenene (CHEBI:63701) has role plant metabolite (CHEBI:76924)
(−)-α-cuprenene (CHEBI:63701) is a alicyclic compound (CHEBI:33654)
(−)-α-cuprenene (CHEBI:63701) is a sesquiterpene (CHEBI:35189)
IUPAC Name 
1-methyl-4-[(1S)-1,2,2-trimethylcyclopentyl]cyclohexa-1,3-diene
UniProt Name  Source
(−)-α-cupreneneUniProt
Manual XrefsDatabases
C00036712KNApSAcK
Registry NumbersSources
Reaxys:8143778Reaxys
Citations