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CHEBI:189981 - 7-hydroxy-3-(hydroxymethyl)-1H-isochromen-1-one

ChEBI IDCHEBI:189981
ChEBI Name7-hydroxy-3-(hydroxymethyl)-1H-isochromen-1-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H8O4
Net Charge0
Average Mass192.170
Monoisotopic Mass192.04226
SMILESO=c1oc(CO)cc2ccc(O)cc12
InChIInChI=1S/C10H8O4/c11-5-8-3-6-1-2-7(12)4-9(6)10(13)14-8/h1-4,11-12H,5H2
InChIKeyHCFGZEWOHLZFHH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
marine plankton environmental sample (ncbitaxon:632957) endometabolome MetaboLights (MTBLS3038)
ChEBI Ontology
Outgoing Relation(s)
7-hydroxy-3-(hydroxymethyl)-1H-isochromen-1-one (CHEBI:189981) is a isocoumarins (CHEBI:38758)
IUPAC Name 
7-hydroxy-3-(hydroxymethyl)isochromen-1-one
Manual XrefsDatabases
HMDB0128620HMDB
74852277ChemSpider