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CHEBI:198127 - 6,8-dihydroxy-1-methylisochroman-3-one

ChEBI IDCHEBI:198127
ChEBI Name6,8-dihydroxy-1-methylisochroman-3-one
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SubmitterMetaboLights
DownloadsMolfile
FormulaC10H10O4
Net Charge0
Average Mass194.186
Monoisotopic Mass194.05791
SMILESC[C@@H]1OC(=O)Cc2cc(O)cc(O)c21
InChIInChI=1S/C10H10O4/c1-5-10-6(3-9(13)14-5)2-7(11)4-8(10)12/h2,4-5,11-12H,3H2,1H3/t5-/m0/s1
InChIKeyAIJQFRIMFUSUEZ-YFKPBYRVSA-N
ChEBI Ontology
Outgoing Relation(s)
6,8-dihydroxy-1-methylisochroman-3-one (CHEBI:198127) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
6,8-dihydroxy-1-methyl-1,4-dihydroisochromen-3-one
Manual XrefsDatabases
32681550ChemSpider