RefMet Compound Details
MW structure | 38758 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Theaflavin | |
Systematic name | 3,4,6-trihydroxy-2,8-bis[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl]-5H-benzo[7]annulen-5-one | |
SMILES | c1c2cc(c(c(c2c(=O)c(cc1[C@@H]1[C@@H](Cc2c(cc(cc2O1)O)O)O)O)O)O)[C@@H]1[C@@H](Cc2c(cc(cc2O1)O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 564.126780 (neutral) |