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CHEBI:61685 - (+)-cubenene

ChEBI IDCHEBI:61685
ChEBI Name(+)-cubenene
Stars
DefinitionA sesquiterpene that is 1,6-dimethyl-4-(propan-2-yl)naphthalene in which the naphthalene ring has been hydrogenated at the 1, 2, 3, 4, 4a and 7 positions (the 1S,4R,4aS diastereoisomer).
Last Modified23 October 2012
SubmitterGareth Owen
DownloadsMolfile
FormulaC15H24
Net Charge0
Average Mass204.357
Monoisotopic Mass204.18780
SMILES[H][C@]12C=C(C)CC=C1[C@@H](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/h7,9-10,12-13,15H,5-6,8H2,1-4H3/t12-,13+,15+/m0/s1
InChIKeyJUQGWBAOQUBVFP-GZBFAFLISA-N
ChEBI Ontology
Outgoing Relation(s)
(+)-cubenene (CHEBI:61685) is a carbobicyclic compound (CHEBI:36785)
(+)-cubenene (CHEBI:61685) is a sesquiterpene (CHEBI:35189)
IUPAC Name 
(1S,4R,4aS)-1,6-dimethyl-4-(propan-2-yl)-1,2,3,4,4a,7-hexahydronaphthalene
UniProt Name  Source
(+)-cubeneneUniProt
Manual XrefsDatabases
CPD-12880MetaCyc
Registry NumbersSources
Reaxys:6501109Reaxys