OntologieschebiclassesCHEBI:32544   
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nicotinate
http://purl.obolibrary.org/obo/CHEBI_32544

A pyridinemonocarboxylate that is the conjugate base of nicotinic acid, arising from deprotonation of the carboxy group; major species at pH 7.3.

Also appears infypoectophipomicroslm + 5
Exact Synonyms
nicotinate
pyridine-3-carboxylate
Related Synonyms
3-pyridinecarboxylate
class Information
charge

-1

formula

C6H4NO2

has_obo_namespace

chebi_ontology

inchi

InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)/p-1

inchikey

PVNIIMVLHYAWGP-UHFFFAOYSA-M

in_subset

3_STAR

mass

122.10150

monoisotopicmass

122.02475

smiles

[O-]C(=O)c1cccnc1

class Relations