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CHEBI:57917 - 4-nitrophenolate

ChEBI IDCHEBI:57917
ChEBI Name4-nitrophenolate
Stars
DefinitionA phenolate anion that is the conjugate base of 4-nitrophenol; major species at pH 7.3.
Last Modified24 November 2014
DownloadsMolfile
FormulaC6H4NO3
Net Charge-1
Average Mass138.102
Monoisotopic Mass138.01967
SMILESO=[N+]([O-])c1ccc([O-])cc1
InChIInChI=1S/C6H5NO3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H/p-1
InChIKeyBTJIUGUIPKRLHP-UHFFFAOYSA-M
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Role:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
ChEBI Ontology
Outgoing Relation(s)
4-nitrophenolate (CHEBI:57917) has role human xenobiotic metabolite (CHEBI:76967)
4-nitrophenolate (CHEBI:57917) is a phenolate anion (CHEBI:50525)
4-nitrophenolate (CHEBI:57917) is conjugate base of 4-nitrophenol (CHEBI:16836)
Incoming Relation(s)
4-nitrophenol (CHEBI:16836) is conjugate acid of 4-nitrophenolate (CHEBI:57917)
IUPAC Name 
4-nitrophenolate
Synonyms  Source
4-nitrophenolate anionChEBI
4-nitrophenolate(1−)ChEBI
4-nitrobenzen-1-olateChEBI
p-nitrophenolateChEBI
p-nitrophenolate anionChEBI
p-nitrophenolate(1−)ChEBI
UniProt Name  Source
4-nitrophenolUniProt
Registry NumbersSources
Beilstein:3589511Beilstein
Gmelin:3310Gmelin