Chemical Component Summary

NameS-(P-NITROBENZYL)GLUTATHIONE
Identifiers(2S)-2-azanyl-5-[[(2R)-1-(carboxymethylamino)-3-[(4-nitrophenyl)methylsulfanyl]-1-oxo-propan-2-yl]amino]-5-oxo-pentanoic acid
FormulaC17 H22 N4 O8 S
Molecular Weight442.444
TypeNON-POLYMER
Isomeric SMILESc1cc(ccc1CSC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)[N+](=O)[O-]
InChIInChI=1S/C17H22N4O8S/c18-12(17(26)27)5-6-14(22)20-13(16(25)19-7-15(23)24)9-30-8-10-1-3-11(4-2-10)21(28)29/h1-4,12-13H,5-9,18H2,(H,19,25)(H,20,22)(H,23,24)(H,26,27)/t12-,13-/m0/s1
InChIKeyOAWORKDPTSAMBZ-STQMWFEESA-N

Chemical Details

Formal Charge0
Atom Count52
Chiral Atom Count2
Bond Count52
Aromatic Bond Count6

Drug Info: DrugBank

DrugBank IDDB03686 
NameS-(4-nitrobenzyl)glutathione
Groups experimental
Synonyms
  • S-(4-nitrobenzyl)glutathione
  • S-(p-nitrobenzyl)glutathione
Categories
  • Amino Acids, Peptides, and Proteins
  • Oligopeptides
  • Peptides
CAS number6803-19-6

Drug Targets

NameTarget SequencePharmacological ActionActions
Glutathione S-transferase PMPPYTVVYFPVRGRCAALRMLLADQGQSWKEEVVTVETWQEGSLKASCLY...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 97538
ChEBI CHEBI:87407