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dimethylsulfonioacetate

PropertiesImage
MNX_IDMNXM4190 Image of MNXM4190
referencechebi:16471
formulaC4H8O2S
global charge0
mol weight120.173
InChIKeyPSBDWGZCVUAZQS-UHFFFAOYSA-N
InChIInChI=1S/C4H8O2S/c1-7(2)3-4(5)6/h3H2,1-2H3
SMILESC[S+](C)CC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C4H8O2S/c1-7(2)3-4(5)6/h3H2,1-2H3 Image of MNXM4190
SMILES (mnx)[CH3:1][S+:7]([CH3:2])[CH2:3][C:4](=[O:5])[O-:6]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:16471
chebi:16471
PSBDWGZCVUAZQS-UHFFFAOYSA-N 		dimethylsulfonioacetate
(dimethylsulfonio)acetate
sulfobetaine

CHEBI:4623
chebi:4623
PSBDWGZCVUAZQS-UHFFFAOYSA-O 		(carboxymethyl)(dimethyl)sulfonium
Dimethylsulfonioacetate

kegg.compound:C03392
keggC:C03392
PSBDWGZCVUAZQS-UHFFFAOYSA-O 		Dimethylsulfonioacetate

seed.compound:cpd02146
seedM:cpd02146
PSBDWGZCVUAZQS-UHFFFAOYSA-N 		Dimethylsulfonioacetate
carboxymethyl-dimethyl-sulfonium
dimethylsulfonioacetate
hmdb:HMDB0258591
PSBDWGZCVUAZQS-UHFFFAOYSA-N 		Sulfobetaine
(Dimethylsulfonio)acetic acid
(Dimethylsulphonio)acetate
(Dimethylsulphonio)acetic acid
2-(dimethylsulfaniumyl)acetate
2-Dimethylsulfonioacetate
Dimethylsulfonioacetate
Dimethylsulfonioacetic acid
Dimethylsulphonioacetate
Dimethylsulphonioacetic acid
Sulphobetaine
sulfobetaine

metacyc.compound:DIMETHYLSULFONIOACETATE
metacycM:DIMETHYLSULFONIOACETATE
PSBDWGZCVUAZQS-UHFFFAOYSA-N 		thetin
carboxymethyl-dimethyl-sulfonium
dimethylsulfonioacetate
sulfobetaine

chebi:14176
chebi:23817
keggC:M_C03392
seedM:M_cpd02146 		secondary/obsolete/fantasy identifier