RefMet Compound Details
MW structure | 48436 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Wybutoxine | |
Systematic name | methyl 4-{4,6-dimethyl-9-oxo-1H,4H,9H-imidazo[1,2-a]purin-7-yl}-3-hydroperoxy-2-[(methoxycarbonyl)amino]butanoate | |
SMILES | Cc1c(CC(C(C(=O)OC)NC(=O)OC)OO)n2c(=O)c3c(nc[nH]3)n(C)c2n1 Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 408.139349 (neutral) |