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CHEBI:141473 - S-methylglutathione zwitterion

ChEBI IDCHEBI:141473
ChEBI NameS-methylglutathione zwitterion
Stars
ASCII NameS-methylglutathione zwitterion
DefinitionA zwitterion resulting from the transfer of a proton for the carboxy group to the amino group of the L-γ-glutamyl residue of S-methylglutathione.
Last Modified20 July 2018
SubmitterGareth Owen
DownloadsMolfile
FormulaC11H19N3O6S
Net Charge0
Average Mass321.355
Monoisotopic Mass321.09946
SMILESCSC[C@H](NC(=O)CC[C@H]([NH3+])C(=O)[O-])C(=O)NCC(=O)O
InChIInChI=1S/C11H19N3O6S/c1-21-5-7(10(18)13-4-9(16)17)14-8(15)3-2-6(12)11(19)20/h6-7H,2-5,12H2,1H3,(H,13,18)(H,14,15)(H,16,17)(H,19,20)/t6-,7-/m0/s1
InChIKeyQTQDDTSVRVWHMO-BQBZGAKWSA-N
ChEBI Ontology
Outgoing Relation(s)
S-methylglutathione zwitterion (CHEBI:141473) is a zwitterion (CHEBI:27369)
S-methylglutathione zwitterion (CHEBI:141473) is conjugate acid of S-methyl glutathione(1−) (CHEBI:141467)
S-methylglutathione zwitterion (CHEBI:141473) is tautomer of S-methylglutathione (CHEBI:141472)
Incoming Relation(s)
S-methyl glutathione(1−) (CHEBI:141467) is conjugate base of S-methylglutathione zwitterion (CHEBI:141473)
S-methylglutathione (CHEBI:141472) is tautomer of S-methylglutathione zwitterion (CHEBI:141473)
IUPAC Name 
N-[(4S)-4-azaniumyl-4-carboxylatobutanoyl]-S-methyl-L-cysteinylglycine