RefMet Compound Details

MW structure37382 (View MW Metabolite Database details)
RefMet nameHippuric acid
Systematic name2-(phenylformamido)acetic acid
SMILESc1ccc(cc1)C(=O)NCC(=O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass179.058244 (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
FormulaC9H9NO3View other entries in RefMet with this formula
InChIKeyQIAFMBKCNZACKA-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassPolyketides
Main ClassPhenolic acids
Sub ClassPhenolic acids
Pubchem CID464
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving Hippuric acid

Rxn IDKEGG ReactionEnzyme
R02452 Benzoyl-CoA + Glycine <=> CoA + Hippuratebenzoyl-CoA:glycine N-benzoyltransferase

Table of KEGG human pathways containing Hippuric acid

Pathway IDHuman Pathway# of reactions
hsa00360 Phenylalanine metabolism 1