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CHEBI:63709 - bicyclogermacrene

ChEBI IDCHEBI:63709
ChEBI Namebicyclogermacrene
Stars
DefinitionA sesquiterpene derived from germacrane by dehydrogenation across the C(1)‒C(10) and C(4)‒C(5) bonds and cyclisation across the C(8)‒C(9) bond.
Last Modified25 January 2012
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC15H24
Net Charge0
Average Mass204.357
Monoisotopic Mass204.18780
SMILESC/C1=C\[C@H]2[C@@H](CC/C(C)=C/CC1)C2(C)C
InChIInChI=1S/C15H24/c1-11-6-5-7-12(2)10-14-13(9-8-11)15(14,3)4/h6,10,13-14H,5,7-9H2,1-4H3/b11-6+,12-10+/t13-,14+/m1/s1
InChIKeyVPDZRSSKICPUEY-JEPMYXAXSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
bicyclogermacrene (CHEBI:63709) has parent hydride germacrane (CHEBI:36514)
bicyclogermacrene (CHEBI:63709) has role metabolite (CHEBI:25212)
bicyclogermacrene (CHEBI:63709) is a sesquiterpene (CHEBI:35189)
IUPAC Name 
(1S,2E,6E,10R)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene
UniProt Name  Source
bicyclogermacreneUniProt
Manual XrefsDatabases
LMPR0103100001LIPID MAPS
Registry NumbersSources
Reaxys:4231307Reaxys
Citations