CHEBI:16894 - 3-sulfopyruvic acid

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ChEBI Name 3-sulfopyruvic acid
ChEBI ID CHEBI:16894
Definition A carboxyalkanesulfonic acid comprising pyruvic acid with a sulfo group attached at the C-3 position.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:45736, CHEBI:11891, CHEBI:1669
Supplier Information
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Formula C3H4O6S
Net Charge 0
Average Mass 168.12626
InChI InChI=1S/C3H4O6S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,5,6)(H,7,8,9)
InChIKey BUTHMSUEBYPMKJ-UHFFFAOYSA-N
SMILES OC(=O)C(=O)CS(O)(=O)=O
Metabolite of Species Details
Mus musculus (NCBI:10090) Source: BioModels - MODEL1507180067 See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3-sulfopyruvic acid (CHEBI:16894) has functional parent pyruvic acid (CHEBI:32816)
3-sulfopyruvic acid (CHEBI:16894) has role mouse metabolite (CHEBI:75771)
3-sulfopyruvic acid (CHEBI:16894) is a carboxyalkanesulfonic acid (CHEBI:38031)
3-sulfopyruvic acid (CHEBI:16894) is conjugate acid of 3-sulfonatopyruvate(2−) (CHEBI:57940)
Incoming 3-sulfonatopyruvate(2−) (CHEBI:57940) is conjugate base of 3-sulfopyruvic acid (CHEBI:16894)
IUPAC Name
2-oxo-3-sulfopropanoic acid
Synonyms Sources
2-carboxy-2-oxoethanesulfonic acid ChemIDplus
3-Sulfopyruvate KEGG COMPOUND
3-Sulfopyruvic acid KEGG COMPOUND
β-sulfopyruvic acid ChemIDplus
SULFOPYRUVATE PDBeChem
Database Links Databases
C00000764 KNApSAcK
C05528 KEGG COMPOUND
DB02156 DrugBank
SPV PDBeChem
View more database links
Registry Numbers Types Sources
1775450 Beilstein Registry Number Beilstein
98022-26-5 CAS Registry Number ChemIDplus
Last Modified
27 January 2016