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2-S-Glutathionyl acetate

Properties

Image

Occurences in reactions

MNX_ID

MNXM5771

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	2

formula

C₁₂H₁₉N₃O₈S

charge

mass

365.08929

reference

chebi:34302

InChIKey

WBINJBFJLWYSJZ-BQBZGAKWSA-N

InChI

InChI=1S/C12H19N3O8S/c13-6(12(22)23)1-2-8(16)15-7(4-24-5-10(19)20)11(21)14-3-9(17)18/h6-7H,1-5,13H2,(H,14,21)(H,15,16)(H,17,18)(H,19,20)(H,22,23)/t6-,7-/m0/s1

SMILES

N[C@@H](CCC(=O)N[C@@H](CSCC(=O)O)C(=O)NCC(=O)O)C(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:34302 chebi:34302 kegg.compound:C14862 keggC:C14862	2-S-Glutathionyl acetate S-(Carboxymethyl)glutathione
sabiork.compound:22108 sabiorkM:22108	2-S-Glutathionyl acetate Glutathione-S-acetate S-(Carboxymethyl)glutathione S-Carboxymethyl-glutathione
seed.compound:cpd10559 seedM:cpd10559	2-S-Glutathionyl acetate S-(Carboxymethyl)glutathione S-(acet-2-yl)-glutathione glutathione-S-acetate
hmdb:HMDB0062198	2-S-glutathionyl acetate (2S)-2-Amino-4-{[(1R)-1-[(carboxymethyl)-C-hydroxycarbonimidoyl]-2-[(carboxymethyl)sulfanyl]ethyl]-C-hydroxycarbonimidoyl}butanoate (2S)-2-Amino-4-{[(1R)-1-[(carboxymethyl)-C-hydroxycarbonimidoyl]-2-[(carboxymethyl)sulphanyl]ethyl]-C-hydroxycarbonimidoyl}butanoate (2S)-2-Amino-4-{[(1R)-1-[(carboxymethyl)-C-hydroxycarbonimidoyl]-2-[(carboxymethyl)sulphanyl]ethyl]-C-hydroxycarbonimidoyl}butanoic acid (2S)-2-amino-4-{[(1R)-1-[(carboxymethyl)-C-hydroxycarbonimidoyl]-2-[(carboxymethyl)sulfanyl]ethyl]-C-hydroxycarbonimidoyl}butanoic acid 2-S-Glutathionyl acetic acid S-(Carboxymethyl)glutathione
metacyc.compound:CPD0-2370 metacycM:CPD0-2370	S-(acet-2-yl)-glutathione
hmdb:HMDB62198 keggC:M_C14862 seedM:M_cpd10559	secondary/obsolete/fantasy identifier