RefMet Compound Details
MW structure | 21950 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Gallocatechin 3-O-gallate | |
Systematic name | [(2R,3S)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate | |
SMILES | c1c(cc(c(c1O)O)O)[C@@H]1[C@H](Cc2c(cc(cc2O1)O)O)OC(=O)c1cc(c(c(c1)O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 458.084915 (neutral) |