CHEBI:1665 - 3-sulfinylpyruvic acid

ChEBI IDCHEBI:1665
ChEBI Name3-sulfinylpyruvic acid
Stars
DefinitionA pyruvic acid compound having a 3-sulfinyl substituent.
Last Modified22 August 2019
DownloadsMolfile
FormulaC3H4O5S
Net Charge0
Average Mass152.127
Monoisotopic Mass151.97794
SMILESO=C(O)C(=O)CS(=O)O
InChIInChI=1S/C3H4O5S/c4-2(3(5)6)1-9(7)8/h1H2,(H,5,6)(H,7,8)
InChIKeyJXYLQEMXCAAMOL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
3-sulfinylpyruvic acid (CHEBI:1665) has functional parent pyruvic acid (CHEBI:32816)
3-sulfinylpyruvic acid (CHEBI:1665) has role human metabolite (CHEBI:77746)
3-sulfinylpyruvic acid (CHEBI:1665) has role mouse metabolite (CHEBI:75771)
3-sulfinylpyruvic acid (CHEBI:1665) is a 2-oxo monocarboxylic acid (CHEBI:35910)
3-sulfinylpyruvic acid (CHEBI:1665) is a organosulfinic acid (CHEBI:37783)
3-sulfinylpyruvic acid (CHEBI:1665) is a sulfur-containing carboxylic acid (CHEBI:33576)
3-sulfinylpyruvic acid (CHEBI:1665) is conjugate acid of 3-sulfinatopyruvate(2−) (CHEBI:140699)
Incoming Relation(s)
3-sulfinatopyruvate(2−) (CHEBI:140699) is conjugate base of 3-sulfinylpyruvic acid (CHEBI:1665)
IUPAC Name 
2-oxo-3-sulfinopropanoic acid
Synonyms  Source
3-SulfinylpyruvateKEGG COMPOUND
3-SulfinopyruvateKEGG COMPOUND
Manual XrefsDatabases
C05527KEGG COMPOUND