RefMet Compound Details
MW structure | 53223 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Hyperforin | |
Systematic name | (1R,5S,6R,7S)-4-hydroxy-6-methyl-1,3,7-tris(3-methylbut-2-en-1-yl)-6-(4-methylpent-3-en-1-yl)-5-(2-methylpropanoyl)bicyclo[3.3.1]non-3-ene-2,9-dione | |
SMILES | CC(=CCC[C@]1(C)[C@@H](CC=C(C)C)C[C@]2(CC=C(C)C)C(=O)C(=C([C@@]1(C(=O)C(C)C)C2=O)O)CC=C(C)C)C Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 536.386560 (neutral) |