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CHEBI:8927 - S-(2,4-dinitrophenyl)glutathione

ChEBI IDCHEBI:8927
ChEBI NameS-(2,4-dinitrophenyl)glutathione
Stars
ASCII NameS-(2,4-dinitrophenyl)glutathione
DefinitionA glutathione conjugate in which the thiol hydrogen of glutathione has been replaced by a 2,4-dinitrophenyl group.
Secondary ChEBI IDCHEBI:42826
Last Modified17 January 2020
DownloadsMolfile
FormulaC16H19N5O10S
Net Charge0
Average Mass473.420
Monoisotopic Mass473.08526
SMILESN[C@@H](CCC(=O)N[C@@H](CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)NCC(=O)O)C(=O)O
InChIInChI=1S/C16H19N5O10S/c17-9(16(26)27)2-4-13(22)19-10(15(25)18-6-14(23)24)7-32-12-3-1-8(20(28)29)5-11(12)21(30)31/h1,3,5,9-10H,2,4,6-7,17H2,(H,18,25)(H,19,22)(H,23,24)(H,26,27)/t9-,10-/m0/s1
InChIKeyFXEUKVKGTKDDIQ-UWVGGRQHSA-N
ChEBI Ontology
Outgoing Relation(s)
S-(2,4-dinitrophenyl)glutathione (CHEBI:8927) has functional parent glutathione (CHEBI:16856)
S-(2,4-dinitrophenyl)glutathione (CHEBI:8927) is a glutathione conjugate (CHEBI:24335)
S-(2,4-dinitrophenyl)glutathione (CHEBI:8927) is conjugate acid of S-(2,4-dinitrophenyl)glutathione(1−) (CHEBI:133977)
Incoming Relation(s)
S-(2,4-dinitrophenyl)glutathione(1−) (CHEBI:133977) is conjugate base of S-(2,4-dinitrophenyl)glutathione (CHEBI:8927)
IUPAC Name 
L-γ-glutamyl-S-(2,4-dinitrophenyl)-L-cysteinylglycine
Synonyms  Source
dinitrophenyl-S-glutathioneChEBI
DNP-SGMetaCyc
DNP-S-glutathioneChEBI
S-(2,4-Dinitrophenyl)glutathioneKEGG COMPOUND
Manual XrefsDatabases
C11175KEGG COMPOUND
GDNPDBeChem
S-24-DINITROPHENYLGLUTATHIONEMetaCyc
Registry NumbersSources
Beilstein:2033318Beilstein
Reaxys:2199791Reaxys
CAS:26289-39-4ChemIDplus
CAS:26289-39-4KEGG COMPOUND
Citations