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CHEBI:63703 - (−)-δ-cadinene

ChEBI IDCHEBI:63703
ChEBI Name(−)-δ-cadinene
Stars
ASCII Name(-)-delta-cadinene
DefinitionA member of the cadinene family of sesquiterpenes in which the double bonds are located at the 4-4a and 7-8 positions, and in which the isopropyl group at position 1 is cis to the hydrogen at the adjacent bridgehead carbon (the 1R,8aS-enantiomer).
Last Modified25 January 2012
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC15H24
Net Charge0
Average Mass204.357
Monoisotopic Mass204.18780
SMILES[H][C@]12C=C(C)CCC1=C(C)CC[C@@H]2C(C)C
InChIInChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h9-10,13,15H,5-8H2,1-4H3/t13-,15-/m1/s1
InChIKeyFUCYIEXQVQJBKY-UKRRQHHQSA-N
Roles Classification
Biological Role:
volatile oil component  Any plant metabolite that is found naturally as a component of a volatile oil.
ChEBI Ontology
Outgoing Relation(s)
(−)-δ-cadinene (CHEBI:63703) is a cadinene (CHEBI:22976)
(−)-δ-cadinene (CHEBI:63703) is a δ-cadinene (CHEBI:140564)
(−)-δ-cadinene (CHEBI:63703) is enantiomer of (+)-δ-cadinene (CHEBI:15385)
Incoming Relation(s)
(+)-δ-cadinene (CHEBI:15385) is enantiomer of (−)-δ-cadinene (CHEBI:63703)
IUPAC Name 
(1R,8aS)-4,7-dimethyl-1-(propan-2-yl)-1,2,3,5,6,8a-hexahydronaphthalene
Synonym  Source
(1R,8aS)-4,7-dimethyl-1-isopropyl-1,2,3,5,6,8a-hexahydronaphthaleneChEBI
UniProt Name  Source
(−)-δ-cadineneUniProt
Registry NumbersSources
Reaxys:2501562Reaxys
Citations