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CHEBI:211215 - Penicillilactone A

ChEBI IDCHEBI:211215
ChEBI NamePenicillilactone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H8O4
Net Charge0
Average Mass180.159
Monoisotopic Mass180.04226
SMILESCOC1=Cc2cocc2COC1=O
InChIInChI=1S/C9H8O4/c1-11-8-2-6-3-12-4-7(6)5-13-9(8)10/h2-4H,5H2,1H3
InChIKeyDSBWFZHJPDAYAV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (29553833)
ChEBI Ontology
Outgoing Relation(s)
Penicillilactone A (CHEBI:211215) is a heteroarene (CHEBI:33833)
IUPAC Name 
7-methoxy-4H-uro[3,4-c]oxepin-6-one
Manual XrefsDatabases
76712484ChemSpider