EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:38023 - 3-sulfolactic acid

ChEBI IDCHEBI:38023
ChEBI Name3-sulfolactic acid
Stars
DefinitionThe C-sulfonato derivaive of lactic acid.
Last Modified28 July 2014
DownloadsMolfile
FormulaC3H6O6S
Net Charge0
Average Mass170.142
Monoisotopic Mass169.98851
SMILESO=C(O)C(O)CS(=O)(=O)O
InChIInChI=1S/C3H6O6S/c4-2(3(5)6)1-10(7,8)9/h2,4H,1H2,(H,5,6)(H,7,8,9)
InChIKeyCQQGIWJSICOUON-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-sulfolactic acid (CHEBI:38023) has functional parent rac-lactic acid (CHEBI:28358)
3-sulfolactic acid (CHEBI:38023) is a carboxyalkanesulfonic acid (CHEBI:38031)
3-sulfolactic acid (CHEBI:38023) is conjugate acid of 3-sulfonatolactate(2−) (CHEBI:58683)
Incoming Relation(s)
(R)-3-sulfolactic acid (CHEBI:48291) is a 3-sulfolactic acid (CHEBI:38023)
(S)-3-sulfolactic acid (CHEBI:16712) is a 3-sulfolactic acid (CHEBI:38023)
3-sulfonatolactate(2−) (CHEBI:58683) is conjugate base of 3-sulfolactic acid (CHEBI:38023)
IUPAC Name 
2-hydroxy-3-sulfopropanoic acid
Manual XrefsDatabases
C16069KEGG COMPOUND
Registry NumbersSources
Beilstein:6900115Beilstein