RefMet Compound Details
MW structure | 70355 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Apigenin 7-O-(6-malonyl-beta-D-glucoside) | |
Systematic name | 3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-chromen-7-yl]oxy-tetrahydropyran-2-yl]methoxy]propanoic acid | |
SMILES | c1cc(ccc1c1cc(=O)c2c(cc(cc2o1)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](COC(=O)CC(=O)O)O1)O)O)O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 518.106041 (neutral) |