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CHEBI:191131 - Methyl 7-methoxycoumarin-4-acetate

ChEBI IDCHEBI:191131
ChEBI NameMethyl 7-methoxycoumarin-4-acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H12O5
Net Charge0
Average Mass248.234
Monoisotopic Mass248.06847
SMILESCOC(=O)Cc1cc(=O)oc2cc(OC)ccc12
InChIInChI=1S/C13H12O5/c1-16-9-3-4-10-8(5-12(14)17-2)6-13(15)18-11(10)7-9/h3-4,6-7H,5H2,1-2H3
InChIKeyIEMSTXMWFNGNTK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) INS-1 cell (BTO:0002135) MetaboLights (MTBLS3963)
ChEBI Ontology
Outgoing Relation(s)
Methyl 7-methoxycoumarin-4-acetate (CHEBI:191131) is a coumarins (CHEBI:23403)
IUPAC Name 
methyl 2-(7-methoxy-2-oxochromen-4-yl)acetate
Manual XrefsDatabases
1156750ChemSpider