EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:173338 - 3-Methylbutyrolactone

ChEBI IDCHEBI:173338
ChEBI Name3-Methylbutyrolactone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC5H8O2
Net Charge0
Average Mass100.117
Monoisotopic Mass100.05243
SMILESCC1COC(=O)C1
InChIInChI=1S/C5H8O2/c1-4-2-5(6)7-3-4/h4H,2-3H2,1H3
InChIKeyALZLTHLQMAFAPA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-Methylbutyrolactone (CHEBI:173338) is a γ-lactone (CHEBI:37581)
IUPAC Name 
4-methyloxolan-2-one
Manual XrefsDatabases
HMDB0002167HMDB
88906ChemSpider
Registry NumbersSources
CAS:1679-49-8ChemIDplus