RefMet Compound Details
MW structure | 69364 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Tremulacin | |
Systematic name | beta-D-Glucopyranoside, 2-(((((1-hydroxy-6-oxo-2-cyclohexen-1-yl)carbonyl)oxy)methyl)phenyl), 2-benzoate | |
SMILES | c1ccc(cc1)C(=O)O[C@@H]1[C@H]([C@@H]([C@@H](CO)O[C@H]1Oc1ccccc1COC(=O)C1(C=CCCC1=O)O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 528.163165 (neutral) |