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S-succinylglutathione

PropertiesImage
MNX_IDMNXM4811 Image of MNXM4811
referencechebi:57556
formulaC14H19N3O9S
global charge-2
mol weight405.385
InChIKeyCEWPGJBJGGBRQM-YUMQZZPRSA-L
InChIInChI=1S/C14H21N3O9S/c15-7(14(25)26)1-2-9(18)17-8(13(24)16-5-11(21)22)6-27-12(23)4-3-10(19)20/h7-8H,1-6,15H2,(H,16,24)(H,17,18)(H,19,20)(H,21,22)(H,25,26)/p-2/t7-,8-/m0/s1
SMILES[NH3+][C@@H](CCC(=O)N[C@@H](CSC(=O)CCC(=O)[O-])C(=O)NCC(=O)[O-])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C14H21N3O9S/c15-7(14(25)26)1-2-9(18)17-8(13(24)16-5-11(21)22)6-27-12(23)4-3-10(19)20/h7-8H,1-6,15H2,(H,16,24)(H,17,18)(H,19,20)(H,21,22)(H,25,26)/t7-,8-/m0/s1 Image of MNXM4811
SMILES (mnx)[CH2:1]([CH2:2][C:9](=[N:17][C@@H:8]([CH2:6][S:27][C:12]([CH2:4][CH2:3][C:10](=[O:19])[OH:20])=[O:23])[C:13](=[N:16][CH2:5][C:11](=[O:21])[OH:22])[OH:24])[OH:18])[C@@H:7]([C:14](=[O:25])[OH:26])[NH2:15]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:57556
chebi:57556
CEWPGJBJGGBRQM-YUMQZZPRSA-L 		S-succinylglutathione
(2S)-2-azaniumyl-5-({(2R)-1-[(carboxylatomethyl)amino]-3-[(3-carboxylatopropanoyl)sulfanyl]-1-oxopropan-2-yl}amino)-5-oxopentanoate
S-(3-carboxylatopropanoyl)glutathionate dianion
S-(3-carboxylatopropanoyl)glutathionate(2-)

metacyc.compound:CPD-549
metacycM:CPD-549
CEWPGJBJGGBRQM-YUMQZZPRSA-L 		S-(3-carboxypropanoyl)glutathionate

sabiork.compound:2691
sabiorkM:2691
kegg.compound:C03174
keggC:C03174
CEWPGJBJGGBRQM-YUMQZZPRSA-N 		S-Succinylglutathione

seed.compound:cpd02029
seedM:cpd02029
CEWPGJBJGGBRQM-YUMQZZPRSA-L 		S-Succinylglutathione
S-succinylglutathione

CHEBI:15892
chebi:15892
CEWPGJBJGGBRQM-YUMQZZPRSA-N 		S-succinylglutathione
L-gamma-glutamyl-S-(3-carboxypropanoyl)-L-cysteinylglycine
S-Succinylglutathione

chebi:12774
chebi:22074
chebi:8972
keggC:M_C03174
seedM:M_cpd02029 		secondary/obsolete/fantasy identifier