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CHEBI:231783 - (+)-sativene

ChEBI IDCHEBI:231783
ChEBI Name(+)-sativene
Stars
DefinitionA sesquiterpene that is octahydro-1H-1,4-methanoindene bearing methyl, isopropyl and methylidene substituents at positions 4, 7 and 8 respectively (the 1S,3aR,4S,7S,7aS-isomer).
Last Modified16 September 2024
SubmitterAnne Morgat
DownloadsMolfile
FormulaC15H24
Net Charge0
Average Mass204.357
Monoisotopic Mass204.18780
SMILES[H][C@]12CC[C@]3([H])C(=C)[C@@]1(C)CC[C@@H](C(C)C)[C@]23[H]
InChIInChI=1S/C15H24/c1-9(2)11-7-8-15(4)10(3)12-5-6-13(15)14(11)12/h9,11-14H,3,5-8H2,1-2,4H3/t11-,12+,13+,14-,15+/m0/s1
InChIKeyVOBBUADSYROGAT-VYDRJRHOSA-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)
(+)-sativene (CHEBI:231783) has role plant metabolite (CHEBI:76924)
(+)-sativene (CHEBI:231783) is a bridged compound (CHEBI:35990)
(+)-sativene (CHEBI:231783) is a sesquiterpene (CHEBI:35189)
IUPAC Name 
(1S,3aR,4S,7S,7aS)-4-methyl-8-methylidene-7-(propan-2-yl)octahydro-1H-1,4-methanoindene
UniProt Name  Source
(+)-sativeneUniProt
Manual XrefsDatabases
C20275KEGG COMPOUND
CPD-8804MetaCyc
21169458ChemSpider
Registry NumbersSources
Reaxys:6566323Reaxys
CAS:3650-28-0NIST Chemistry WebBook
Citations