CHEBI:201053 - 4-(hydroxymethyl)-5-hydroxy-2H-pyran-2-one

ChEBI IDCHEBI:201053
ChEBI Name4-(hydroxymethyl)-5-hydroxy-2H-pyran-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC6H6O4
Net Charge0
Average Mass142.110
Monoisotopic Mass142.02661
SMILESO=c1cc(CO)c(O)co1
InChIInChI=1S/C6H6O4/c7-2-4-1-6(9)10-3-5(4)8/h1,3,7-8H,2H2
InChIKeyYHVOEGJCPPEQKG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus flavus (ncbitaxon:5059) - PubMed (18503205)
ChEBI Ontology
Outgoing Relation(s)
4-(hydroxymethyl)-5-hydroxy-2H-pyran-2-one (CHEBI:201053) is a pyranone (CHEBI:37963)
IUPAC Name 
5-hydroxy-4-(hydroxymethyl)pyran-2-one
Manual XrefsDatabases
27023795ChemSpider