EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:217894 - Violapyrone J

ChEBI IDCHEBI:217894
ChEBI NameViolapyrone J
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H18O3
Net Charge0
Average Mass210.273
Monoisotopic Mass210.12559
SMILESCC[C@H](C)CCc1cc(O)c(C)c(=O)o1
InChIInChI=1S/C12H18O3/c1-4-8(2)5-6-10-7-11(13)9(3)12(14)15-10/h7-8,13H,4-6H2,1-3H3/t8-/m0/s1
InChIKeyIHTSJVCQAKTIMC-QMMMGPOBSA-N
Species of MetaboliteComponentSourceComments
Cylindrocarponspecies (ncbitaxon:1756108) - PubMed (29778573)
ChEBI Ontology
Outgoing Relation(s)
Violapyrone J (CHEBI:217894) is a pyranone (CHEBI:37963)
IUPAC Name 
4-hydroxy-3-methyl-6-(3-methylpentyl)pyran-2-one
Manual XrefsDatabases
44210900ChemSpider