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CHEBI:16208 - 3-mercaptopyruvic acid
| Formula | C3H4O3S |
| Net Charge | 0 |
| Average Mass | 120.129 |
| Monoisotopic Mass | 119.98811 |
| SMILES | O=C(O)C(=O)CS |
| InChI | InChI=1S/C3H4O3S/c4-2(1-7)3(5)6/h7H,1H2,(H,5,6) |
| InChIKey | OJOLFAIGOXZBCI-UHFFFAOYSA-N |
| Wikipedia |
|---|
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Escherichia coli (ncbitaxon:562) | - | PubMed (21988831) | |
| 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: | Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. 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). |
| Application: | antidote to cyanide poisoning A role borne by a molecule that acts to counteract or neutralize the deleterious effects of cyanide. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-mercaptopyruvic acid (CHEBI:16208) has functional parent pyruvic acid (CHEBI:32816) |
| 3-mercaptopyruvic acid (CHEBI:16208) has role Escherichia coli metabolite (CHEBI:76971) |
| 3-mercaptopyruvic acid (CHEBI:16208) has role antidote to cyanide poisoning (CHEBI:90749) |
| 3-mercaptopyruvic acid (CHEBI:16208) has role human metabolite (CHEBI:77746) |
| 3-mercaptopyruvic acid (CHEBI:16208) has role mouse metabolite (CHEBI:75771) |
| 3-mercaptopyruvic acid (CHEBI:16208) is a 2-oxo monocarboxylic acid (CHEBI:35910) |
| 3-mercaptopyruvic acid (CHEBI:16208) is a thiol (CHEBI:29256) |
| 3-mercaptopyruvic acid (CHEBI:16208) is conjugate acid of 3-mercaptopyruvate (CHEBI:57678) |
| Incoming Relation(s) |
| 3-mercaptopyruvate (CHEBI:57678) is conjugate base of 3-mercaptopyruvic acid (CHEBI:16208) |
| IUPAC Name |
|---|
| 2-oxo-3-sulfanylpropanoic acid |
| Synonyms | Source |
|---|---|
| 3-mercapto-2-oxopropanoic acid | ChemIDplus |
| 3-Mercaptopyruvate | KEGG COMPOUND |
| 3-Mercaptopyruvic acid | KEGG COMPOUND |
| Mercaptopyruvate | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| 3-MERCAPTO-PYRUVATE | MetaCyc |
| 3-Mercaptopyruvic_acid | Wikipedia |
| C00007464 | KNApSAcK |
| C00957 | KEGG COMPOUND |
| ECMDB01368 | ECMDB |
| HMDB0001368 | HMDB |
| Registry Numbers | Sources |
|---|---|
| Reaxys:1747058 | Reaxys |
| CAS:2464-23-5 | ChemIDplus |
| CAS:2464-23-5 | KEGG COMPOUND |
| Citations |
|---|