RefMet Compound Details

MW structure37133 (View MW Metabolite Database details)
RefMet namePhenylpyruvic acid
Systematic name2-oxo-3-phenylpropanoic acid
SMILESc1ccc(cc1)CC(=O)C(=O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass164.047345 (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
FormulaC9H8O3View other entries in RefMet with this formula
InChIKeyBTNMPGBKDVTSJY-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassOrganic acids
Main ClassPhenylpropanoids
Sub ClassCinnamic acids
Pubchem CID997
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving Phenylpyruvic acid

Rxn IDKEGG ReactionEnzyme
R00688 L-Phenylalanine + H2O + NAD+ <=> Phenylpyruvate + Ammonia + NADH + H+L-phenylalanine:NAD+ oxidoreductase (deaminating)
R01372 Phenylpyruvate + Oxygen <=> 2-Hydroxyphenylacetate + CO2Phenylpyruvate:oxygen oxidoreductase (hydroxylating,decarboxylating)
R00694 L-Phenylalanine + 2-Oxoglutarate <=> Phenylpyruvate + L-GlutamateL-Phenylalanine:2-oxoglutarate aminotransferase
R00689 L-Phenylalanine + H2O + Oxygen <=> Phenylpyruvate + Ammonia + Hydrogen peroxideL-Phenylalanine:oxygen oxidoreductase (deaminating)
R00692 L-Phenylalanine + Pyruvate <=> Phenylpyruvate + L-AlanineL-phenylalanine:pyruvate aminotransferase
R01378 Phenylpyruvate <=> 2-Hydroxy-3-phenylpropenoatePhenylpyruvate keto-enol-isomerase

Table of KEGG human pathways containing Phenylpyruvic acid

Pathway IDHuman Pathway# of reactions
hsa00360 Phenylalanine metabolism 4
hsa00400 Phenylalanine, tyrosine and tryptophan biosynthesis 2
hsa01100 Metabolic pathways 2