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cysteineglutathione disulfide

PropertiesImage
MNX_IDMNXM48304 Image of MNXM48304
referencechebi:143243
formulaC13H22N4O8S2
global charge0
mol weight426.473
InChIKeyBNRXZEPOHPEEAS-PPSBICQBSA-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
SMILESNC(CSSC[C@H](NC(=O)CC[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 MNXM48304
SMILES (mnx)[CH2:1]([CH2:2][C:9](=[N:17][C@@H:8]([CH2:5][S:27][S:26][CH2:4][CH: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)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:143243
chebi:143243
BNRXZEPOHPEEAS-PPSBICQBSA-N
cysteineglutathione disulfide
hmdb:HMDB0000656
BNRXZEPOHPEEAS-PPSBICQBSA-N
Cysteineglutathione disulfide
(2S)-2-Amino-4-{[(1R)-2-[(2-amino-2-carboxyethyl)disulfanyl]-1-[(carboxymethyl)-C-hydroxycarbonimidoyl]ethyl]-C-hydroxycarbonimidoyl}butanoate
(2S)-2-Amino-4-{[(1R)-2-[(2-amino-2-carboxyethyl)disulphanyl]-1-[(carboxymethyl)-C-hydroxycarbonimidoyl]ethyl]-C-hydroxycarbonimidoyl}butanoate
(2S)-2-Amino-4-{[(1R)-2-[(2-amino-2-carboxyethyl)disulphanyl]-1-[(carboxymethyl)-C-hydroxycarbonimidoyl]ethyl]-C-hydroxycarbonimidoyl}butanoic acid
(2S)-2-amino-4-{[(1R)-2-[(2-amino-2-carboxyethyl)disulfanyl]-1-(carboxymethylcarbamoyl)ethyl]carbamoyl}butanoic acid
(2S)-2-amino-4-{[(1R)-2-[(2-amino-2-carboxyethyl)disulfanyl]-1-[(carboxymethyl)carbamoyl]ethyl]carbamoyl}butanoic acid
CYSSG
Cysteine glutathione disulphide
Cysteine-glutathione disulfide
Cysteine-glutathione mixed disulfide
Cysteineglutathione disulphide
Nereithione

hmdb:HMDB00656
secondary/obsolete/fantasy identifier