RefMet Compound Details

MW structure38156 (View MW Metabolite Database details)
RefMet namealpha-Hydroxyhippuric acid
Systematic name2-hydroxy-2-(phenylformamido)acetic acid
SMILESc1ccc(cc1)C(=O)NC(C(=O)O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass195.053159 (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
FormulaC9H9NO4View other entries in RefMet with this formula
InChIKeyGCWCVCCEIQXUQU-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassBenzenoids
Main ClassBenzamides
Sub ClassHippuric acids
Pubchem CID450272
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)