Quinolinic Acid
Quinolinic_acid synonyms
Quinolinate; Pyridine-2,3-dicarboxylic acid; 2,3-Pyridinedicarboxylic acid; QUINOLINIC ACID; Pyridine-2,3-dicarboxylate
Graphical representations:
View large 3D structure
Molecular Formula: C7H5NO4
Natural Isotopic Abundance Mass: 167.1189000000
Mono-Isotopic Molecular Masses:
- C12N14: 167.021857654
- C13N14: 174.045341519
- C12N15: 168.018892547
- C13N15: 175.0423764119
InChI string: InChI=1S/C7H5NO4/c9-6(10)4-2-1-3-8-5(4)7(11)12/h1-3H,(H,9,10)(H,11,12)
IUPAC: pyridine-2,3-dicarboxylic acid
PubChem Compound (CID): 1066KEGG Compound ID: C03722
CAS Registry number: 18970-62-2 87314-99-6 89-00-9
ChEBI: 16675
EINECS: 201-874-8
NSC: 13127
PDB Compound ID: NTM
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)