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CHEBI:214921 - 6,8-dihydroxy-3-(2S-hydroxypropyl)-7-methyl-1H-isochromen-1-one

ChEBI IDCHEBI:214921
ChEBI Name6,8-dihydroxy-3-(2S-hydroxypropyl)-7-methyl-1H-isochromen-1-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H14O5
Net Charge0
Average Mass250.250
Monoisotopic Mass250.08412
SMILESCc1c(O)cc2cc(C[C@H](C)O)oc(=O)c2c1O
InChIInChI=1S/C13H14O5/c1-6(14)3-9-4-8-5-10(15)7(2)12(16)11(8)13(17)18-9/h4-6,14-16H,3H2,1-2H3/t6-/m0/s1
InChIKeyCYNSEHMNJAFNCN-LURJTMIESA-N
Species of MetaboliteComponentSourceComments
Eurotium (ncbitaxon:28569) - PubMed (28586721)
ChEBI Ontology
Outgoing Relation(s)
6,8-dihydroxy-3-(2S-hydroxypropyl)-7-methyl-1H-isochromen-1-one (CHEBI:214921) is a isocoumarins (CHEBI:38758)
IUPAC Name 
6,8-dihydroxy-3-[(2S)-2-hydroxypropyl]-7-methylisochromen-1-one
Manual XrefsDatabases
63002623ChemSpider