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CHEBI:43445 - (+)-aristolochene

ChEBI IDCHEBI:43445
ChEBI Name(+)-aristolochene
Stars
Secondary ChEBI IDsCHEBI:32418, CHEBI:43441
Last Modified23 March 2015
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC15H24
Net Charge0
Average Mass204.357
Monoisotopic Mass204.18780
SMILESC=C(C)[C@H]1CC=C2CCC[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/h9,12-13H,1,5-8,10H2,2-4H3/t12-,13-,15+/m0/s1
InChIKeyYONHOSLUBQJXPR-KCQAQPDRSA-N
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
(+)-aristolochene (CHEBI:43445) is a aristolochene (CHEBI:36529)
(+)-aristolochene (CHEBI:43445) is enantiomer of (−)-aristolochene (CHEBI:18027)
Incoming Relation(s)
(−)-aristolochene (CHEBI:18027) is enantiomer of (+)-aristolochene (CHEBI:43445)
IUPAC Names 
(4S,4aR,6S)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene
7βH-eremophila-9,11-diene
Synonyms  Source
(1S,7S,8aR)-aristolocheneChEBI
(+)-AristolocheneKEGG COMPOUND
AristolocheneKEGG COMPOUND
UniProt Name  Source
(+)-aristolocheneUniProt
Manual XrefsDatabases
C02004KEGG COMPOUND
Registry NumbersSources
Beilstein:3588801Beilstein
CAS:123408-96-8KEGG COMPOUND