Nicotinic Acid
Niacin synonyms
Nicotamin; Pyridine-carboxylique-3 [French]; SK-Niacin; Pelonin; Pyridine-beta-carboxylic acid; Nicocidin; Nicolar; NAH; Daskil; Niaspan; Niacin [USAN]
Graphical representations:
View large 3D structure
Molecular Formula: C6H5NO2
Natural Isotopic Abundance Mass: 123.1094000000
Mono-Isotopic Molecular Masses:
- C12N14: 123.03202841
- C13N14: 129.052157437
- C12N15: 124.029063303
- C13N15: 130.0491923299
InChI string: InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)
IUPAC: pyridine-3-carboxylic acid
PubChem Compound (CID): 938KEGG Compound ID: C00253
CAS Registry number: 10361-13-4 123574-58-3 16518-17-5 1976-28-9 28029-53-0 28029-54-1 36321-41-2 3789-96-6 53890-72-5 54-86-4 59-67-6 636-79-3 7069-06-9 823-77-8 99148-57-9
ChEBI: 15940
Beilstein Handbook Reference: 5-22-02-00057
NSC: 169454
EINECS: 200-441-0
CCRIS: 1902
HSDB: 3134
PDB Compound ID: NIO
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)