(2-carboxyethyl)(dimethyl)sulfonium (CHEBI:230554)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	(2-carboxyethyl)(dimethyl)sulfonium

ChEBI ID	CHEBI:230554

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C5H11O2S

Net Charge

Average Mass

135.200

Monoisotopic Mass

135.04743

InChI

InChI=1S/C5H10O2S/c1-8(2)4-3-5(6)7/h3-4H2,1-2H3/p+1

InChIKey

DFPOZTRSOAQFIK-UHFFFAOYSA-O

SMILES

[S+](CCC(O)=O)(C)C

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in feces (BTO:0000440). See: MetaboLights Study

ChEBI Ontology
Outgoing	(2-carboxyethyl)(dimethyl)sulfonium (CHEBI:230554) is a organic molecular entity (CHEBI:50860)

IUPAC Name

2-carboxyethyl(dimethyl)sulanium