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CHEBI:202737 - 1-[(3E)-3-(chloromethylidene)-6-hydroxy-1-benzoxepin-7-yl]ethanone

ChEBI IDCHEBI:202737
ChEBI Name1-[(3E)-3-(chloromethylidene)-6-hydroxy-1-benzoxepin-7-yl]ethanone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H11ClO3
Net Charge0
Average Mass250.681
Monoisotopic Mass250.03967
SMILESCC(=O)c1ccc2c(c1O)C=C/C(=C\Cl)CO2
InChIInChI=1S/C13H11ClO3/c1-8(15)10-4-5-12-11(13(10)16)3-2-9(6-14)7-17-12/h2-6,16H,7H2,1H3/b9-6+
InChIKeyVJBAYCOWPLRVFA-RMKNXTFCSA-N
Species of MetaboliteComponentSourceComments
Mycena galopus (ncbitaxon:41248) - DOI (10.1016/s0040-4039(99)01074-6)
ChEBI Ontology
Outgoing Relation(s)
1-[(3E)-3-(chloromethylidene)-6-hydroxy-1-benzoxepin-7-yl]ethanone (CHEBI:202737) is a oxacycle (CHEBI:38104)
IUPAC Name 
1-[(3E)-3-(chloromethylidene)-6-hydroxy-1-benzoxepin-7-yl]ethanone
Manual XrefsDatabases
9023621ChemSpider