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CHEBI:67050 - S-methyl-L-methioninate

ChEBI IDCHEBI:67050
ChEBI NameS-methyl-L-methioninate
Stars
ASCII NameS-methyl-L-methioninate
DefinitionA sulfonium betaine that is a conjugate base of S-methyl-L-methionine obtained by the deprotonation of the carboxy group.
Last Modified17 December 2014
Submitternamrata
DownloadsMolfile
FormulaC6H13NO2S
Net Charge0
Average Mass163.242
Monoisotopic Mass163.06670
SMILESC[S+](C)CC[C@H](N)C(=O)[O-]
InChIInChI=1S/C6H13NO2S/c1-10(2)4-3-5(7)6(8)9/h5H,3-4,7H2,1-2H3/t5-/m0/s1
InChIKeyYDBYJHTYSHBBAU-YFKPBYRVSA-N
ChEBI Ontology
Outgoing Relation(s)
S-methyl-L-methioninate (CHEBI:67050) has functional parent L-methioninate (CHEBI:32631)
S-methyl-L-methioninate (CHEBI:67050) is a methyl-L-methionine (CHEBI:25268)
S-methyl-L-methioninate (CHEBI:67050) is a sulfonium betaine (CHEBI:35282)
S-methyl-L-methioninate (CHEBI:67050) is conjugate base of S-methyl-L-methionine (CHEBI:17728)
Incoming Relation(s)
S-methyl-L-methionine (CHEBI:17728) is conjugate acid of S-methyl-L-methioninate (CHEBI:67050)
IUPAC Name 
(2S)-2-amino-4-(dimethylsulfonio)butanoate