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CHEBI:155906 - dauca-4,7-diene

ChEBI IDCHEBI:155906
ChEBI Namedauca-4,7-diene
Stars
DefinitionA carbobicylic compound that is (8aS)-1,2,3,3a,4,5,8,8a-octahydroazulene substituted by a propan-2-ylidene, methyl and methyl groups at positions 1, 3aR and 6, respectively.
Last Modified26 June 2020
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC15H24
Net Charge0
Average Mass204.357
Monoisotopic Mass204.18780
SMILES[H][C@]12CC=C(C)CC[C@]1(C)CCC2=C(C)C
InChIInChI=1S/C15H24/c1-11(2)13-8-10-15(4)9-7-12(3)5-6-14(13)15/h5,14H,6-10H2,1-4H3/t14-,15-/m1/s1
InChIKeyBHSLMCXELUOVBY-HUUCEWRRSA-N
Roles Classification
Biological Role:
Aspergillus metabolite  Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus .
ChEBI Ontology
Outgoing Relation(s)
dauca-4,7-diene (CHEBI:155906) has role Aspergillus metabolite (CHEBI:76956)
dauca-4,7-diene (CHEBI:155906) is a carbocyclic compound (CHEBI:33598)
dauca-4,7-diene (CHEBI:155906) is a polycyclic olefin (CHEBI:35714)
dauca-4,7-diene (CHEBI:155906) is a sesquiterpene (CHEBI:35189)
IUPAC Name 
(3aR,8aS)-3a,6-dimethyl-1-(propan-2-ylidene)-1,2,3,3a,4,5,8,8a-octahydroazulene
UniProt Name  Source
dauca-4,7-dieneUniProt
Citations