RefMet Compound Details

MW structure53852 (View MW Metabolite Database details)
RefMet nameN-Acetylmethionine
Systematic nameN-acetyl-L-methionine
SMILESCC(=O)N[C@@H](CCSC)C(=O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass191.061616 (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
FormulaC7H13NO3SView other entries in RefMet with this formula
InChIKeyXUYPXLNMDZIRQH-LURJTMIESA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassOrganic acids
Main ClassAmino acids and peptides
Sub ClassAmino acids
Pubchem CID448580
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)