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CHEBI:227549 - Aspergone A

ChEBI IDCHEBI:227549
ChEBI NameAspergone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14O3
Net Charge0
Average Mass194.230
Monoisotopic Mass194.09429
SMILESCCCC1=C/C(=C/C=C/CO)OC1=O
InChIInChI=1S/C11H14O3/c1-2-5-9-8-10(14-11(9)13)6-3-4-7-12/h3-4,6,8,12H,2,5,7H2,1H3/b4-3+,10-6-
InChIKeyLHWZKEKNRRLGSK-UMJNYJJFSA-N
Species of MetaboliteComponentSourceComments
Aspergillusspecies OUCMDZ-1583 (ncbitaxon:1548012) - DOI (10.1039/c5ra11185d)
ChEBI Ontology
Outgoing Relation(s)
Aspergone A (CHEBI:227549) is a butenolide (CHEBI:50523)
IUPAC Name 
(5Z)-5-[(E)-4-hydroxybut-2-enylidene]-3-propyluran-2-one
Manual XrefsDatabases
40256839ChemSpider