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CHEBI:18027 - (−)-aristolochene

ChEBI IDCHEBI:18027
ChEBI Name(−)-aristolochene
Stars
ASCII Name(-)-aristolochene
Secondary ChEBI IDsCHEBI:2824, CHEBI:13855
Last Modified11 December 2008
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+/m1/s1
InChIKeyYONHOSLUBQJXPR-NFAWXSAZSA-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:18027) is a aristolochene (CHEBI:36529)
(−)-aristolochene (CHEBI:18027) is enantiomer of (+)-aristolochene (CHEBI:43445)
Incoming Relation(s)
(+)-aristolochene (CHEBI:43445) is enantiomer of (−)-aristolochene (CHEBI:18027)
IUPAC Names 
(4R,4aS,6R)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene
4βH,5α-eremophila-9,11-diene
Synonyms  Source
(1R,7R,8aS)-aristolocheneChEBI
AristolocheneKEGG COMPOUND
AristolocheneChemIDplus
UniProt Name  Source
(-)-aristolocheneUniProt
Manual XrefsDatabases
C02004KEGG COMPOUND
Registry NumbersSources
Beilstein:2249047Beilstein
Beilstein:3588802Beilstein
CAS:26620-71-3ChemIDplus