CHEBI:89255 - S-Methyl butanethioate

ChEBI IDCHEBI:89255
ChEBI NameS-Methyl butanethioate
Stars
DownloadsMolfile
FormulaC5H10OS
Net Charge0
Average Mass118.201
Monoisotopic Mass118.04524
SMILESCCCC(=O)SC
InChIInChI=1S/C5H10OS/c1-3-4-5(6)7-2/h3-4H2,1-2H3
InChIKeyGRLJIIJNZJVMGP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) faeces (UBERON:0001988) PubMed (17314143)
ChEBI Ontology
Outgoing Relation(s)
S-Methyl butanethioate (CHEBI:89255) is a thiocarboxylic ester (CHEBI:26959)
Synonyms  Source
1-(methylsulfanyl)butan-1-oneHMDB
Butanethioic acid, S-methyl esterHMDB
Butyric acid, thio-, S-methyl esterHMDB
FEMA 3310HMDB
Methane N-thiolbutyrateHMDB
Methanethiol butyrateHMDB
Manual XrefsDatabases
HMDB0031191HMDB
Registry NumbersSources
CAS:2432-51-1KEGG COMPOUND
Citations