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CHEBI:79222 - 3-sulfinopropionic acid

ChEBI IDCHEBI:79222
ChEBI Name3-sulfinopropionic acid
Stars
DefinitionA monocarboxylic acid that is propionic acid in which one of the methyl hydrogens is replaced by a sulfino group.
Last Modified16 July 2014
SubmitterSteve
DownloadsMolfile
FormulaC3H6O4S
Net Charge0
Average Mass138.144
Monoisotopic Mass137.99868
SMILESO=C(O)CCS(=O)O
InChIInChI=1S/C3H6O4S/c4-3(5)1-2-8(6)7/h1-2H2,(H,4,5)(H,6,7)
InChIKeyGBHSTQUVJWQJOK-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-sulfinopropionic acid (CHEBI:79222) is a monocarboxylic acid (CHEBI:25384)
3-sulfinopropionic acid (CHEBI:79222) is a organosulfinic acid (CHEBI:37783)
3-sulfinopropionic acid (CHEBI:79222) is conjugate acid of 3-sulfinatopropionate (CHEBI:137673)
Incoming Relation(s)
3-sulfinopropionyl-CoA (CHEBI:79221) has functional parent 3-sulfinopropionic acid (CHEBI:79222)
3-sulfinatopropionate (CHEBI:137673) is conjugate base of 3-sulfinopropionic acid (CHEBI:79222)
IUPAC Name 
3-sulfinopropanoic acid
Manual XrefsDatabases
CPD-16584MetaCyc
Registry NumbersSources
Reaxys:1759839Reaxys
Citations