EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:195253 - 5-hydroxy-3-methylfuran-2(5H)-one

ChEBI IDCHEBI:195253
ChEBI Name5-hydroxy-3-methylfuran-2(5H)-one
Stars
ASCII Name5-hydroxy-3-methylfuran-2(5H)-one
DefinitionA butenolide that is furan-2(5H)-one substituted by a methyl group at position 3 and a hydroxy group at position 4.
Last Modified2 June 2023
SubmitterElisabeth Coudert
DownloadsMolfile
FormulaC5H6O3
Net Charge0
Average Mass114.100
Monoisotopic Mass114.03169
SMILESCC1=CC(O)OC1=O
InChIInChI=1S/C5H6O3/c1-3-2-4(6)8-5(3)7/h2,4,6H,1H3
InChIKeyHQIZYPQNJWENRT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Litsea verticillata (ncbitaxon:1009487) - PubMed (15931585)
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
anti-HIV agent  An antiviral agent that destroys or inhibits the replication of the human immunodeficiency virus.
ChEBI Ontology
Outgoing Relation(s)
5-hydroxy-3-methylfuran-2(5H)-one (CHEBI:195253) has role anti-HIV agent (CHEBI:64946)
5-hydroxy-3-methylfuran-2(5H)-one (CHEBI:195253) has role plant metabolite (CHEBI:76924)
5-hydroxy-3-methylfuran-2(5H)-one (CHEBI:195253) is a butenolide (CHEBI:50523)
5-hydroxy-3-methylfuran-2(5H)-one (CHEBI:195253) is a secondary allylic alcohol (CHEBI:134396)
IUPAC Name 
5-hydroxy-3-methylfuran-2(5H)-one
Synonyms  Source
2-hydroxy-4-methyl-2H-furan-5-oneChEBI
5-hydroxy-3-methyl-2(5H)-furanoneChEBI
5-hydroxy-3-methyl-2,5-dihydrofuran-2-oneChEBI
UniProt Name  Source
5-hydroxy-3-methylfuran-2(5H)-oneUniProt
Registry NumbersSources
Reaxys:1280983Reaxys
CAS:931-23-7ChEBI
Citations