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CHEBI:63035 - sulfocholine

ChEBI IDCHEBI:63035
ChEBI Namesulfocholine
Stars
DefinitionA sulfonium compound that is mercaptoethanol bearing two S-methyl substituents.
Last Modified7 October 2011
SubmitterSteve
DownloadsMolfile
FormulaC4H11OS
Net Charge+1
Average Mass107.198
Monoisotopic Mass107.05251
SMILESC[S+](C)CCO
InChIInChI=1S/C4H11OS/c1-6(2)4-3-5/h5H,3-4H2,1-2H3/q+1
InChIKeyDPYMRUOGINZSQM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
sulfocholine (CHEBI:63035) has functional parent mercaptoethanol (CHEBI:41218)
sulfocholine (CHEBI:63035) is a organic cation (CHEBI:25697)
sulfocholine (CHEBI:63035) is a primary alcohol (CHEBI:15734)
sulfocholine (CHEBI:63035) is a sulfonium compound (CHEBI:26830)
Incoming Relation(s)
phosphatidylsulfocholine (CHEBI:63034) has functional parent sulfocholine (CHEBI:63035)
IUPAC Name 
(2-hydroxyethyl)(dimethyl)sulfonium
Synonym  Source
2-hydroxyethyldimethylsulfonium cationChEBI
Registry NumbersSources
Reaxys:1735517Reaxys
CAS:21368-49-0ChemIDplus