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CHEBI:74031 - 3-sulfopropanoic acid

ChEBI IDCHEBI:74031
ChEBI Name3-sulfopropanoic acid
Stars
DefinitionA carboxyalkanesulfonic acid that is the C-sulfo derivative of propanoic acid.
Last Modified19 September 2013
Submittermwilliams
DownloadsMolfile
FormulaC3H6O5S
Net Charge0
Average Mass154.143
Monoisotopic Mass153.99359
SMILESO=C(O)CCS(=O)(=O)O
InChIInChI=1S/C3H6O5S/c4-3(5)1-2-9(6,7)8/h1-2H2,(H,4,5)(H,6,7,8)
InChIKeyOURSFPZPOXNNKX-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
3-sulfopropanoic acid (CHEBI:74031) has functional parent propionic acid (CHEBI:30768)
3-sulfopropanoic acid (CHEBI:74031) has role metabolite (CHEBI:25212)
3-sulfopropanoic acid (CHEBI:74031) is a carboxyalkanesulfonic acid (CHEBI:38031)
IUPAC Name 
3-sulfopropanoic acid
Registry NumbersSources
Reaxys:1706376Reaxys
CAS:6306-41-8ChemIDplus