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CHEBI:61267 - 5-nitroanthranilate

ChEBI IDCHEBI:61267
ChEBI Name5-nitroanthranilate
Stars
DefinitionAn anthranilate obtained by removal of a proton from the carboxylic acid group of 5-nitroanthranilic acid.
Last Modified8 February 2011
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC7H5N2O4
Net Charge-1
Average Mass181.127
Monoisotopic Mass181.02548
SMILESNc1ccc([N+](=O)[O-])cc1C(=O)[O-]
InChIInChI=1S/C7H6N2O4/c8-6-2-1-4(9(12)13)3-5(6)7(10)11/h1-3H,8H2,(H,10,11)/p-1
InChIKeyRUCHWTKMOWXHLU-UHFFFAOYSA-M
Roles Classification
Biological Roles:
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
5-nitroanthranilate (CHEBI:61267) is a anthranilate (CHEBI:16567)
5-nitroanthranilate (CHEBI:61267) is conjugate base of 5-nitroanthranilic acid (CHEBI:61280)
Incoming Relation(s)
5-nitroanthranilic acid (CHEBI:61280) is conjugate acid of 5-nitroanthranilate (CHEBI:61267)
IUPAC Name 
2-amino-5-nitrobenzoate
UniProt Name  Source
5-nitroanthranilateUniProt
Manual XrefsDatabases
CPD-12695MetaCyc
Citations