Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-18 00:04:30 UTC
Update Date2024-10-17 18:52:46 UTC
Metabolite IDMMDBc0030345
Metabolite Identification
Common NameSulfoacetate
DescriptionSulfoacetate is a member of the chemical class known as Sulfonic Acids. These are compounds containing the sulfonic acid group, which has the general structure RS(=O)2OH (R = H). Sulfoacetate is invovled in Taurine and hypotaurine metabolism. (KEGG)
Structure
Synonyms
ValueSource
2-Sulfoacetic acidChEBI
SulfoacetateChEBI
Sulfoethanoic acidChEBI
Sulphoacetic acidChEBI
2-SulfoacetateGenerator
2-SulphoacetateGenerator
2-Sulphoacetic acidGenerator
SulphoacetateGenerator
SulfoethanoateGenerator
SulphoethanoateGenerator
Sulphoethanoic acidGenerator
Sulfoacetic acidGenerator, KEGG
Molecular FormulaC2H4O5S
Average Mass140.115
Monoisotopic Mass139.977943928
IUPAC Name2-sulfoacetic acid
Traditional Namesulfoacetic acid
CAS Registry Number123-43-3
SMILES
OC(=O)CS(O)(=O)=O
InChI Identifier
InChI=1S/C2H4O5S/c3-2(4)1-8(5,6)7/h1H2,(H,3,4)(H,5,6,7)
InChI KeyAGGIJOLULBJGTQ-UHFFFAOYSA-N