nicotinate (CHEBI:32544)

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ChEBI Name	nicotinate

ChEBI ID	CHEBI:32544

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

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:25530, CHEBI:14650, CHEBI:22851

Supplier Information

Download	Molfile XML SDF

Formula

C6H4NO2

Net Charge

-1

Average Mass

122.10150

Monoisotopic Mass

122.02475

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

SMILES

[O-]C(=O)c1cccnc1

Metabolite of Species	Details
Saccharomyces cerevisiae (NCBI:txid4932)	Source: yeast.sf.net See: PubMed

Roles Classification
Biological Role(s):	Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. water-soluble vitamin (role) Any vitamin that dissolves in water and readily absorbed into tissues for immediate use. Unlike the fat-soluble vitamins, they are not stored in the body and need to be replenished regularly in the diet and will rarely accumulate to toxic levels since they are quickly excreted from the body via urine. (via B vitamin )

Application(s):	nutraceutical A product in capsule, tablet or liquid form that provide essential nutrients, such as a vitamin, an essential mineral, a protein, an herb, or similar nutritional substance. (via B vitamin )

ChEBI Ontology
Outgoing	nicotinate (CHEBI:32544) has role Saccharomyces cerevisiae metabolite (CHEBI:75772) nicotinate (CHEBI:32544) has role metabolite (CHEBI:25212) nicotinate (CHEBI:32544) is a pyridinemonocarboxylate (CHEBI:38181) nicotinate (CHEBI:32544) is a vitamin B₃ (CHEBI:176839) nicotinate (CHEBI:32544) is conjugate base of nicotinic acid (CHEBI:15940)

Incoming	5-pyridoxate (CHEBI:30960) has functional parent nicotinate (CHEBI:32544) N-glycosylnicotinate (CHEBI:25533) has functional parent nicotinate (CHEBI:32544) N-methylnicotinate (CHEBI:18123) has functional parent nicotinate (CHEBI:32544) nicotinic acid (CHEBI:15940) is conjugate acid of nicotinate (CHEBI:32544)

IUPAC Name

pyridine-3-carboxylate

Last Modified

30 August 2023