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CHEBI:142083 - (−)-4-epi-eremophilene

ChEBI IDCHEBI:142083
ChEBI Name(−)-4-epi-eremophilene
Stars
ASCII Name(-)-4-epi-eremophilene
DefinitionA member of the class of octahydronahthalenes that is (−)-eremophilene in which the carbon bearing the methyl group at position 4 (i.e. the methyl group furthest from the isopropenyl group) has R configuration instead of S.
Last Modified5 September 2018
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC15H24
Net Charge0
Average Mass204.357
Monoisotopic Mass204.18780
SMILESC=C(C)[C@@H]1CCC2=CCC[C@@H](C)[C@@]2(C)C1
InChIInChI=1S/C15H24/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h7,12-13H,1,5-6,8-10H2,2-4H3/t12-,13-,15-/m1/s1
InChIKeyQEBNYNLSCGVZOH-UMVBOHGHSA-N
ChEBI Ontology
Outgoing Relation(s)
(−)-4-epi-eremophilene (CHEBI:142083) is a carbobicyclic compound (CHEBI:36785)
(−)-4-epi-eremophilene (CHEBI:142083) is a octahydronaphthalenes (CHEBI:138397)
(−)-4-epi-eremophilene (CHEBI:142083) is a sesquiterpene (CHEBI:35189)
Incoming Relation(s)
4-epi-eremophilene-2β-ol (CHEBI:142084) has functional parent (−)-4-epi-eremophilene (CHEBI:142083)
IUPAC Name 
(3R,4aR,5R)-4a,5-dimethyl-3-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene
UniProt Name  Source
4-epi-eremophileneUniProt
Citations