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CHEBI:207819 - 5-methyl-3-(2-methylbutyl)-6-pentan-2-ylpyran-2-one

ChEBI IDCHEBI:207819
ChEBI Name5-methyl-3-(2-methylbutyl)-6-pentan-2-ylpyran-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H26O2
Net Charge0
Average Mass250.382
Monoisotopic Mass250.19328
SMILESCCCC(C)c1oc(=O)c(CC(C)CC)cc1C
InChIInChI=1S/C16H26O2/c1-6-8-12(4)15-13(5)10-14(16(17)18-15)9-11(3)7-2/h10-12H,6-9H2,1-5H3
InChIKeyJTEPOCODFJKCCN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Nocardiopsisspecies NHF48 (ncbitaxon:1193283) - PubMed (28918535)
ChEBI Ontology
Outgoing Relation(s)
5-methyl-3-(2-methylbutyl)-6-pentan-2-ylpyran-2-one (CHEBI:207819) is a pyranone (CHEBI:37963)
IUPAC Name 
5-methyl-3-(2-methylbutyl)-6-pentan-2-ylpyran-2-one
Manual XrefsDatabases
71048746ChemSpider