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CHEBI:227560 - Aspergone C

ChEBI IDCHEBI:227560
ChEBI NameAspergone C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC11H16O3
Net Charge0
Average Mass196.246
Monoisotopic Mass196.10994
SMILESCCCC1=C/C(=C/C[C@@H](C)O)OC1=O
InChIInChI=1S/C11H16O3/c1-3-4-9-7-10(14-11(9)13)6-5-8(2)12/h6-8,12H,3-5H2,1-2H3/b10-6-/t8-/m1/s1
InChIKeyTYBSHRBWMSUCMG-NDVARNPJSA-N
Species of MetaboliteComponentSourceComments
Aspergillusspecies OUCMDZ-1583 (ncbitaxon:1548012) - DOI (10.1039/c5ra11185d)
ChEBI Ontology
Outgoing Relation(s)
Aspergone C (CHEBI:227560) is a butenolide (CHEBI:50523)
IUPAC Name 
(5Z)-5-[(3R)-3-hydroxybutylidene]-3-propyluran-2-one
Manual XrefsDatabases
40256841ChemSpider