RefMet Compound Details
MW structure | 69312 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Paederoside | |
Systematic name | carbonothioic acid, O-[[(2aS,4aS,5S,7bS)-5-(beta-D-glucopyranosyloxy)-2a,4a,5,7b-tetrahydro-1-oxo-1H-2,6-dioxacyclopent[cd]inden-4-yl]methyl] S-methyl ester | |
SMILES | CSC(=O)OCC1=C[C@H]2[C@@H]3C(=CO[C@H]([C@H]13)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)C(=O)O2 Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 446.088283 (neutral) |