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CHEBI:198716 - 6-heptyl-2H-pyran-2-one

ChEBI IDCHEBI:198716
ChEBI Name6-heptyl-2H-pyran-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H18O2
Net Charge0
Average Mass194.274
Monoisotopic Mass194.13068
SMILESCCCCCCCc1cccc(=O)o1
InChIInChI=1S/C12H18O2/c1-2-3-4-5-6-8-11-9-7-10-12(13)14-11/h7,9-10H,2-6,8H2,1H3
InChIKeyPBJILRGUPAZAQQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Trichoderma (ncbitaxon:5543) - DOI (10.1002/ejoc.201300049)
ChEBI Ontology
Outgoing Relation(s)
6-heptyl-2H-pyran-2-one (CHEBI:198716) is a pyranone (CHEBI:37963)
IUPAC Name 
6-heptylpyran-2-one
Manual XrefsDatabases
15577220ChemSpider