RefMet Compound Details
MW structure | 43176 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Cocaine | |
Systematic name | methyl (1R,2R,3S,5S)-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate | |
SMILES | CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)OC(=O)c1ccccc1)C(=O)OC Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 303.147059 (neutral) |