EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:199380 - Nectriapyrone C

ChEBI IDCHEBI:199380
ChEBI NameNectriapyrone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14O4
Net Charge0
Average Mass210.229
Monoisotopic Mass210.08921
SMILESCC=C(CO)c1cc(OC)c(C)c(=O)o1
InChIInChI=1S/C11H14O4/c1-4-8(6-12)10-5-9(14-3)7(2)11(13)15-10/h4-5,12H,6H2,1-3H3
InChIKeyHTXMLHOTNKOVND-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Nectriaspecies HLS206 (ncbitaxon:626526) - PubMed (26001271)
ChEBI Ontology
Outgoing Relation(s)
Nectriapyrone C (CHEBI:199380) is a pyranone (CHEBI:37963)
IUPAC Name 
6-(1-hydroxybut-2-en-2-yl)-4-methoxy-3-methylpyran-2-one