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CHEBI:189000 - Nα-benzoyl-L-asparagine 4-nitroanilide

ChEBI IDCHEBI:189000
ChEBI NameNα-benzoyl-L-asparagine 4-nitroanilide
Stars
ASCII NameN(alpha)-benzoyl-L-asparagine 4-nitroanilide
DefinitionAn L-asparagine derivative that is L-asparagine in which the amino group undergoes formal consensation with the carboxy group of benzoic acid and in which the carboxy OH group is replaced by a (4-nitrophenyl)amino group. It is an asparaginyl endopeptidase substrate.
Last Modified12 January 2022
SubmitterSandra Orchard
DownloadsMolfile
FormulaC17H16N4O5
Net Charge0
Average Mass356.338
Monoisotopic Mass356.11207
SMILESNC(=O)C[C@H](NC(=O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C17H16N4O5/c18-15(22)10-14(20-16(23)11-4-2-1-3-5-11)17(24)19-12-6-8-13(9-7-12)21(25)26/h1-9,14H,10H2,(H2,18,22)(H,19,24)(H,20,23)/t14-/m0/s1
InChIKeySLFUSGBNVYEJGY-AWEZNQCLSA-N
ChEBI Ontology
Outgoing Relation(s)
Nα-benzoyl-L-asparagine 4-nitroanilide (CHEBI:189000) is a C-nitro compound (CHEBI:35716)
Nα-benzoyl-L-asparagine 4-nitroanilide (CHEBI:189000) is a L-asparagine derivative (CHEBI:52987)
Nα-benzoyl-L-asparagine 4-nitroanilide (CHEBI:189000) is a benzamides (CHEBI:22702)
Nα-benzoyl-L-asparagine 4-nitroanilide (CHEBI:189000) is a primary carboxamide (CHEBI:140324)
Nα-benzoyl-L-asparagine 4-nitroanilide (CHEBI:189000) is a secondary carboxamide (CHEBI:140325)
IUPAC Name 
N2-benzoyl-N1-(4-nitrophenyl)-L-aspartamide
Synonyms  Source
Bz-Asn-pNASUBMITTER
benzoyl-L-asparaginyl-para-NHPhNO2ChEBI
Nα-benzoyl-L-asparagine 4-nitroanilideChEBI
(2S)-2-benzamido-N1-(4-nitrophenyl)butanediamideIUPAC
benzoyl-Asn-p-nitroanilideChEBI
Bz-Asn-p-nitroanilideChEBI
Registry NumbersSources
CAS:201733-11-1ChEBI
Citations