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CHEBI:205592 - 6-hydroxy-4-[(1S)-1-hydroxyethyl]-8-methoxyisochromen-1-one

ChEBI IDCHEBI:205592
ChEBI Name6-hydroxy-4-[(1S)-1-hydroxyethyl]-8-methoxyisochromen-1-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H12O5
Net Charge0
Average Mass236.223
Monoisotopic Mass236.06847
SMILESCOc1cc(O)cc2c([C@H](C)O)coc(=O)c12
InChIInChI=1S/C12H12O5/c1-6(13)9-5-17-12(15)11-8(9)3-7(14)4-10(11)16-2/h3-6,13-14H,1-2H3/t6-/m0/s1
InChIKeyFSBBOUZYRWGCEM-LURJTMIESA-N
Species of MetaboliteComponentSourceComments
Talaromyces (ncbitaxon:5094) - DOI (10.1039/c6ra02566h)
ChEBI Ontology
Outgoing Relation(s)
6-hydroxy-4-[(1S)-1-hydroxyethyl]-8-methoxyisochromen-1-one (CHEBI:205592) is a isocoumarins (CHEBI:38758)
IUPAC Name 
6-hydroxy-4-[(1S)-1-hydroxyethyl]-8-methoxyisochromen-1-one
Manual XrefsDatabases
58196918ChemSpider