EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:121176 - 6,7-dimethoxy-3-propoxy-3H-isobenzofuran-1-one

ChEBI IDCHEBI:121176
ChEBI Name6,7-dimethoxy-3-propoxy-3H-isobenzofuran-1-one
Stars
DownloadsMolfile
FormulaC13H16O5
Net Charge0
Average Mass252.266
Monoisotopic Mass252.09977
SMILESCCCOC1OC(=O)c2c1ccc(OC)c2OC
InChIInChI=1S/C13H16O5/c1-4-7-17-13-8-5-6-9(15-2)11(16-3)10(8)12(14)18-13/h5-6,13H,4,7H2,1-3H3
InChIKeyDYBVVSHEQOSTBT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6,7-dimethoxy-3-propoxy-3H-isobenzofuran-1-one (CHEBI:121176) is a benzofurans (CHEBI:35259)
Manual XrefsDatabases
LSM-32619LINCS