Chemical Component Summary

Name(S)-2-(PHOSPHONOXY)CAPROYL-L-LEUCYL-P-NITROANILIDE
Identifiers[(2S)-1-[[(2S)-4-methyl-1-[(4-nitrophenyl)amino]-1-oxo-pentan-2-yl]amino]-1-oxo-hexan-2-yl] dihydrogen phosphate
FormulaC18 H28 N3 O8 P
Molecular Weight445.404
TypeNON-POLYMER
Isomeric SMILESCCCC[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(cc1)[N+](=O)[O-])OP(=O)(O)O
InChIInChI=1S/C18H28N3O8P/c1-4-5-6-16(29-30(26,27)28)18(23)20-15(11-12(2)3)17(22)19-13-7-9-14(10-8-13)21(24)25/h7-10,12,15-16H,4-6,11H2,1-3H3,(H,19,22)(H,20,23)(H2,26,27,28)/t15-,16-/m0/s1
InChIKeyHARXAJAHMRMERT-HOTGVXAUSA-N

Chemical Details

Formal Charge0
Atom Count58
Chiral Atom Count2
Bond Count58
Aromatic Bond Count6

Drug Info: DrugBank

DrugBank IDDB02276 
Name(S)-2-(Phosphonoxy)Caproyl-L-Leucyl-P-Nitroanilide
Groups experimental
Synonyms(S)-2-(Phosphonoxy)Caproyl-L-Leucyl-P-Nitroanilide

Drug Targets

NameTarget SequencePharmacological ActionActions
Peptide deformylaseMSVLQVLHIPDERLRKVAKPVEEVNAEIQRIVDDMFETMYAEEGIGLAAT...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 17754079