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CHEBI:231533 - S-(2,4-dinitro-6-hydroxylaminotoluyl)glutathione (1−)

ChEBI IDCHEBI:231533
ChEBI NameS-(2,4-dinitro-6-hydroxylaminotoluyl)glutathione (1−)
Stars
ASCII NameS-(2,4-dinitro-6-hydroxylaminotoluyl)glutathione (1-)
SubmitterElisabeth Coudert
DownloadsMolfile
FormulaC17H21N6O11S
Net Charge-1
Average Mass517.453
Monoisotopic Mass517.09945
SMILES[NH3+][C@@H](CCC(=O)N[C@@H](CSCc1c(NO)cc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)NCC(=O)[O-])C(=O)[O-]
InChIInChI=1S/C17H22N6O11S/c18-10(17(28)29)1-2-14(24)20-12(16(27)19-5-15(25)26)7-35-6-9-11(21-30)3-8(22(31)32)4-13(9)23(33)34/h3-4,10,12,21,30H,1-2,5-7,18H2,(H,19,27)(H,20,24)(H,25,26)(H,28,29)/p-1/t10-,12-/m0/s1
InChIKeyLEOHWHVQWZWNQO-JQWIXIFHSA-M
ChEBI Ontology
Outgoing Relation(s)
S-(2,4-dinitro-6-hydroxylaminotoluyl)glutathione (1−) (CHEBI:231533) is a C-nitro compound (CHEBI:35716)
S-(2,4-dinitro-6-hydroxylaminotoluyl)glutathione (1−) (CHEBI:231533) is a S-substituted glutathione (CHEBI:17021)
UniProt Name  Source
S-(2,4-dinitro-6-hydroxylaminotoluyl)glutathioneUniProt
Citations