CHEBI:57556 - S-(3-carboxylatopropanoyl)glutathionate(2−)

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ChEBI Name S-(3-carboxylatopropanoyl)glutathionate(2−)
ChEBI ID CHEBI:57556
ChEBI ASCII Name S-(3-carboxylatopropanoyl)glutathionate(2-)
Definition Dianion of S-succinylglutathione having anionic carboxy groups and a protonated primary amino group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C14H19N3O9S
Net Charge -2
Average Mass 405.38000
Monoisotopic Mass 405.08530
InChI InChI=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
InChIKey CEWPGJBJGGBRQM-YUMQZZPRSA-L
SMILES [NH3+][C@@H](CCC(=O)N[C@@H](CSC(=O)CCC([O-])=O)C(=O)NCC([O-])=O)C([O-])=O
ChEBI Ontology
Outgoing S-(3-carboxylatopropanoyl)glutathionate(2−) (CHEBI:57556) is a tricarboxylic acid dianion (CHEBI:36300)
S-(3-carboxylatopropanoyl)glutathionate(2−) (CHEBI:57556) is conjugate base of S-succinylglutathione (CHEBI:15892)
Incoming S-succinylglutathione (CHEBI:15892) is conjugate acid of S-(3-carboxylatopropanoyl)glutathionate(2−) (CHEBI:57556)
IUPAC Name
(2S)-2-azaniumyl-5-({(2R)-1-[(carboxylatomethyl)amino]-3-[(3-carboxylatopropanoyl)sulfanyl]-1-oxopropan-2-yl}amino)-5-oxopentanoate
Synonyms Sources
S-(3-carboxylatopropanoyl)glutathionate dianion ChEBI
S-succinylglutathione UniProt
Last Modified
13 November 2017