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CHEBI:68148 - (+)-Shyobunone

ChEBI IDCHEBI:68148
ChEBI Name(+)-Shyobunone
Stars
DefinitionA natural product found in Acorus calamus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC15H24O
Net Charge0
Average Mass220.356
Monoisotopic Mass220.18272
SMILESC=C[C@]1(C)CC[C@@H](C(C)C)C(=O)[C@H]1C(=C)C
InChIInChI=1S/C15H24O/c1-7-15(6)9-8-12(10(2)3)14(16)13(15)11(4)5/h7,10,12-13H,1,4,8-9H2,2-3,5-6H3/t12-,13+,15+/m0/s1
InChIKeyGWHRSRIPLDHJHR-GZBFAFLISA-N
Species of MetaboliteComponentSourceComments
Acorus calamus (ncbitaxon:4465) rhizome (BTO:0001181) PubMed (21563811) Dried and cut rhizomes(ground roots) extracted by maceration with petroleum ether
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)
(+)-Shyobunone (CHEBI:68148) has role metabolite (CHEBI:25212)
(+)-Shyobunone (CHEBI:68148) is a sesquiterpenoid (CHEBI:26658)
Synonym  Source
(2S,3S,6S)-2-Isopropenyl-6-isopropyl-3-methyl-3-vinylcyclohexanoneChEBI
Citations