RefMet Compound Details

MW structure78826 (View MW Metabolite Database details)
RefMet nameHis-Leu
Systematic nameL-Histidyl-L-leucine
SMILESCC(C)C[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass268.153541 (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
FormulaC12H20N4O3View other entries in RefMet with this formula
InChIKeyMMFKFJORZBJVNF-UWVGGRQHSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassOrganic acids
Main ClassAmino acids and peptides
Sub ClassDipeptides
Pubchem CID189008
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)