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S-Glutathionyl-L-cysteine

PropertiesImage
MNX_IDMNXM5925 Image of MNXM5925
referencechebi:8959
formulaC13H22N4O8S2
global charge0
mol weight426.473
InChIKeyBNRXZEPOHPEEAS-FXQIFTODSA-N
InChIInChI=1S/C13H22N4O8S2/c14-6(12(22)23)1-2-9(18)17-8(11(21)16-3-10(19)20)5-27-26-4-7(15)13(24)25/h6-8H,1-5,14-15H2,(H,16,21)(H,17,18)(H,19,20)(H,22,23)(H,24,25)/t6-,7-,8-/m0/s1
SMILESN[C@@H](CCC(=O)N[C@@H](CSSC[C@H](N)C(=O)O)C(=O)NCC(=O)O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C13H22N4O8S2/c14-6(12(22)23)1-2-9(18)17-8(11(21)16-3-10(19)20)5-27-26-4-7(15)13(24)25/h6-8H,1-5,14-15H2,(H,16,21)(H,17,18)(H,19,20)(H,22,23)(H,24,25)/t6-,7-,8-/m0/s1 Image of MNXM5925
SMILES (mnx)[CH2:1]([CH2:2][C:9](=[N:17][C@@H:8]([CH2:5][S:27][S:26][CH2:4][C@@H:7]([C:13](=[O:24])[OH:25])[NH2:15])[C:11](=[N:16][CH2:3][C:10](=[O:19])[OH:20])[OH:21])[OH:18])[C@@H:6]([C:12](=[O:22])[OH:23])[NH2:14]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

sabiork.compound:2798
sabiorkM:2798
CHEBI:8959
chebi:8959
kegg.compound:C05526
keggC:C05526
BNRXZEPOHPEEAS-FXQIFTODSA-N 		S-Glutathionyl-L-cysteine

metacyc.compound:CPD-921
metacycM:CPD-921
BNRXZEPOHPEEAS-FXQIFTODSA-M 		(glutathion-S-yl)-L-cysteine
cysteine-glutathione disulfide
glutathione-L-cysteine mixed-disulfide

CHEBI:21264
chebi:21264
BNRXZEPOHPEEAS-FXQIFTODSA-N 		L-cysteine glutathione disulfide
S-Glutathionyl-L-cysteine

seed.compound:cpd12732
seedM:cpd12732
BNRXZEPOHPEEAS-FXQIFTODSA-M 		S-Glutathionyl-L-cysteine
(glutathion-S-yl)-L-cysteine
S-glutathionyl-L-cysteine
glutathione-L-cysteine mixed-disulfide

keggC:M_C05526
seedM:M_cpd12732 		secondary/obsolete/fantasy identifier