EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:217161 - Pestalafuranone J

ChEBI IDCHEBI:217161
ChEBI NamePestalafuranone J
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14O3
Net Charge0
Average Mass194.230
Monoisotopic Mass194.09429
SMILESCC=CC1=C(C=CCCO)COC1=O
InChIInChI=1S/C11H14O3/c1-2-5-10-9(6-3-4-7-12)8-14-11(10)13/h2-3,5-6,12H,4,7-8H2,1H3
InChIKeyUWSSRVLAQDZZLE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Nigrospora (ncbitaxon:114230) - PubMed (24434694)
ChEBI Ontology
Outgoing Relation(s)
Pestalafuranone J (CHEBI:217161) is a butenolide (CHEBI:50523)
IUPAC Name 
3-(4-hydroxybut-1-enyl)-4-prop-1-enyl-2H-uran-5-one