RefMet Compound Details
MW structure | 67956 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Asperuloside | |
Systematic name | [(2aS,4aS,5S,7bS)-5-(ß-D-Glucopyranosyloxy)-1-oxo-2a,4a,5,7b-tetrahydro-1H-2,6-dioxacyclopenta[cd]inden-4-yl]methyl acetate | |
SMILES | CC(=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 | 414.116215 (neutral) |