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CHEBI:182555 - 7-Hydroxy-3-(2-hydroxy-propyl)-5-methyl-isochromen-1-one

ChEBI IDCHEBI:182555
ChEBI Name7-Hydroxy-3-(2-hydroxy-propyl)-5-methyl-isochromen-1-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H14O4
Net Charge0
Average Mass234.251
Monoisotopic Mass234.08921
SMILESCc1cc(O)cc2c(=O)oc(CC(C)O)cc12
InChIInChI=1S/C13H14O4/c1-7-3-9(15)5-12-11(7)6-10(4-8(2)14)17-13(12)16/h3,5-6,8,14-15H,4H2,1-2H3
InChIKeyQTIXOFRUBMRMTF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
7-Hydroxy-3-(2-hydroxy-propyl)-5-methyl-isochromen-1-one (CHEBI:182555) is a isocoumarins (CHEBI:38758)
IUPAC Name 
7-hydroxy-3-(2-hydroxypropyl)-5-methylisochromen-1-one
Manual XrefsDatabases
22369696ChemSpider