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CHEBI:46878 - dinicotinate(1−)

ChEBI IDCHEBI:46878
ChEBI Namedinicotinate(1−)
Stars
ASCII Namedinicotinate(1-)
Last Modified15 October 2007
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC7H4NO4
Net Charge-1
Average Mass166.112
Monoisotopic Mass166.01458
SMILESO=C([O-])c1cncc(C(=O)O)c1
InChIInChI=1S/C7H5NO4/c9-6(10)4-1-5(7(11)12)3-8-2-4/h1-3H,(H,9,10)(H,11,12)/p-1
InChIKeyMPFLRYZEEAQMLQ-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
dinicotinate(1−) (CHEBI:46878) is a carboxypyridinecarboxylate (CHEBI:46827)
dinicotinate(1−) (CHEBI:46878) is conjugate acid of dinicotinate(2−) (CHEBI:46877)
dinicotinate(1−) (CHEBI:46878) is conjugate base of dinicotinic acid (CHEBI:46875)
Incoming Relation(s)
dinicotinic acid (CHEBI:46875) is conjugate acid of dinicotinate(1−) (CHEBI:46878)
dinicotinate(2−) (CHEBI:46877) is conjugate base of dinicotinate(1−) (CHEBI:46878)
IUPAC Name 
5-carboxypyridine-3-carboxylate
Synonyms  Source
5-carboxynicotinateIUPAC
hydrogen dinicotinateChEBI
Registry NumbersSources
Gmelin:1342587Gmelin