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CHEBI:49221 - (1S,6S)-α-himachalene

Default Structure
ChEBI IDCHEBI:49221
ChEBI Name(1S,6S)-α-himachalene
Stars
ASCII Name(1S,6S)-alpha-himachalene
Last Modified7 May 2008
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC15H24
Net Charge0
Average Mass204.357
Monoisotopic Mass204.18780
SMILES[H][C@]12CCC(C)=C[C@]1([H])C(C)(C)CCCC2=C
InChIInChI=1S/C15H24/c1-11-7-8-13-12(2)6-5-9-15(3,4)14(13)10-11/h10,13-14H,2,5-9H2,1,3-4H3/t13-,14+/m1/s1
InChIKeyZJSIKVDEOWWVEH-KGLIPLIRSA-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)
(1S,6S)-α-himachalene (CHEBI:49221) is a trans-α-himachalene (CHEBI:49217)
(1S,6S)-α-himachalene (CHEBI:49221) is enantiomer of (1R,6R)-α-himachalene (CHEBI:49220)
Incoming Relation(s)
(1R,6R)-α-himachalene (CHEBI:49220) is enantiomer of (1S,6S)-α-himachalene (CHEBI:49221)
IUPAC Names 
1β-himachal-4,11-diene
(4aS,9aS)-3,5,5-trimethyl-9-methylidene-2,4a,5,6,7,8,9,9a-octahydro-1H-benzo[7]annulene
Synonym  Source
(4aS,9aS)-3,5,5-trimethyl-9-methylene-2,4a,5,6,7,8,9,9a-octahydro-1H-benzo[7]annuleneIUPAC
Registry NumbersSources
Beilstein:3048070Beilstein