EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:174468 - 3-Hydroxy-4-butanolide

ChEBI IDCHEBI:174468
ChEBI Name3-Hydroxy-4-butanolide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H16O8
Net Charge0
Average Mass264.230
Monoisotopic Mass264.08452
SMILESO=C1CC(OC2OC(CO)C(O)C(O)C2O)CO1
InChIInChI=1S/C10H16O8/c11-2-5-7(13)8(14)9(15)10(18-5)17-4-1-6(12)16-3-4/h4-5,7-11,13-15H,1-3H2
InChIKeyMQEPWBMWFIVRPS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-Hydroxy-4-butanolide (CHEBI:174468) is a glycoside (CHEBI:24400)
IUPAC Name 
4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-2-one
Manual XrefsDatabases
HMDB0034681HMDB