RefMet Compound Details

MW structure37151 (View MW Metabolite Database details)
RefMet nameQuinolinic acid
Systematic namepyridine-2,3-dicarboxylic acid
SMILESc1cc(c(C(=O)O)nc1)C(=O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass167.021859 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC7H5NO4View other entries in RefMet with this formula
InChIKeyGJAWHXHKYYXBSV-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassAlkaloids
Main ClassNicotinic acid alkaloids
Sub ClassPyridine alkaloids
Pubchem CID1066
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving Quinolinic acid

Rxn IDKEGG ReactionEnzyme
R03348 Nicotinate D-ribonucleotide + Diphosphate + CO2 <=> Quinolinate + 5-Phospho-alpha-D-ribose 1-diphosphateNicotinate-nucleotide:pyrophosphate phosphoribosyltransferase (carboxylating)

Table of KEGG human pathways containing Quinolinic acid

Pathway IDHuman Pathway# of reactions
hsa00760 Nicotinate and nicotinamide metabolism 1