RefMet Compound Details
MW structure | 28059 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Catalpol | |
Systematic name | (1aS,1bS,2S,5aR,6S,6aS)-1a,1b,2,5a,6,6a-Hexahydro-6-hydroxy-1a-(hydroxymethyl)oxireno[4,5]cyclopenta[1,2-c]pyran-2-yl beta-D-glucopyranoside | |
SMILES | C1=CO[C@H]([C@H]2[C@@H]1[C@@H]([C@H]1[C@]2(CO)O1)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 362.121300 (neutral) |