CHEBI:33574 - 4-methylthio-2-oxobutanoic acid

ChEBI IDCHEBI:33574
ChEBI Name4-methylthio-2-oxobutanoic acid
Stars
DefinitionA 2-oxo monocarboxylic acid derived from L-methionine via the action of methionine transaminase.
Secondary ChEBI IDsCHEBI:1902, CHEBI:22458, CHEBI:43720
Last Modified14 February 2017
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC5H8O3S
Net Charge0
Average Mass148.183
Monoisotopic Mass148.01942
SMILESCSCCC(=O)C(=O)O
InChIInChI=1S/C5H8O3S/c1-9-3-2-4(6)5(7)8/h2-3H2,1H3,(H,7,8)
InChIKeySXFSQZDSUWACKX-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4-methylthio-2-oxobutanoic acid (CHEBI:33574) has functional parent L-methionine (CHEBI:16643)
4-methylthio-2-oxobutanoic acid (CHEBI:33574) has functional parent butyric acid (CHEBI:30772)
4-methylthio-2-oxobutanoic acid (CHEBI:33574) is a ω-(methylthio)-2-oxocarboxylic acid (CHEBI:134529)
4-methylthio-2-oxobutanoic acid (CHEBI:33574) is conjugate acid of 4-methylthio-2-oxobutanoate (CHEBI:16723)
Incoming Relation(s)
S-adenosyl-4-methylthio-2-oxobutanoic acid (CHEBI:8944) has functional parent 4-methylthio-2-oxobutanoic acid (CHEBI:33574)
4-methylthio-2-oxobutanoate (CHEBI:16723) is conjugate base of 4-methylthio-2-oxobutanoic acid (CHEBI:33574)
IUPAC Name 
4-(methylsulfanyl)-2-oxobutanoic acid
Synonyms  Source
2-keto-4-methylthiobutyric acidChemIDplus
4-(METHYLSULFANYL)-2-OXOBUTANOIC ACIDPDBeChem
4-methylthio-2-oxobutanoic acidChemIDplus
α-oxo-γ-methylthiobutyric acidChemIDplus
4-Methylthio-2-oxobutanoic acidKEGG COMPOUND
2-Keto-4-methylthiobutyric acidKEGG COMPOUND
Manual XrefsDatabases
C01180KEGG COMPOUND
KMTPDBeChem
LMFA01060170LIPID MAPS
DB02238DrugBank
C00007474KNApSAcK
Registry NumbersSources
Beilstein:1754666Beilstein
CAS:583-92-6ChemIDplus
CAS:583-92-6KEGG COMPOUND