EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:77138 - 3-sulfopropanediol(1−)

ChEBI IDCHEBI:77138
ChEBI Name3-sulfopropanediol(1−)
Stars
ASCII Name3-sulfopropanediol(1-)
DefinitionAn organosulfonate oxoanion that is the conjugate base of 3-sulfolactaldehyde, obtained by deprotonation of the sulfo group; major species at pH 7.3.
Last Modified17 May 2017
SubmitterKAX
DownloadsMolfile
FormulaC3H7O5S
Net Charge-1
Average Mass155.151
Monoisotopic Mass155.00197
SMILESO=S(=O)([O-])CC(O)CO
InChIInChI=1S/C3H8O5S/c4-1-3(5)2-9(6,7)8/h3-5H,1-2H2,(H,6,7,8)/p-1
InChIKeyYPFUJZAAZJXMIP-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
3-sulfopropanediol(1−) (CHEBI:77138) is a alkanesulfonate oxoanion (CHEBI:134249)
3-sulfopropanediol(1−) (CHEBI:77138) is conjugate base of 3-sulfopropanediol (CHEBI:77267)
Incoming Relation(s)
(2R)-3-sulfopropanediol(1−) (CHEBI:60997) is a 3-sulfopropanediol(1−) (CHEBI:77138)
(2S)-3-sulfopropanediol(1−) (CHEBI:176527) is a 3-sulfopropanediol(1−) (CHEBI:77138)
3-sulfopropanediol (CHEBI:77267) is conjugate acid of 3-sulfopropanediol(1−) (CHEBI:77138)
IUPAC Name 
2,3-dihydroxypropane-1-sulfonate
Synonym  Source
2,3-dihydroxypropane-1-sulfonateSUBMITTER
UniProt Name  Source
2,3-dihydroxypropane-1-sulfonateUniProt
Manual XrefsDatabases
2-3-dihydroxypropane-1-sulfonateMetaCyc
Citations