RefMet Compound Details
MW structure | 68849 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Bullatacinone | |
Systematic name | (3S,5R)-3-acetonyl-5-[(11R)-11-hydroxy-11-[(2R,5R)-5-[(2R,5R)-5-[(1S)-1-hydroxyundecyl]tetrahydrofuran-2-yl]tetrahydrofuran-2-yl]undecyl]tetrahydrofuran-2-one | |
SMILES | CCCCCCCCCC[C@@H](C1CC[C@H](C2CC[C@H]([C@@H](CCCCCCCCCC[C@@H]3C[C@@H](CC(=O)C)C(=O)O3)O)O2)O1)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 622.480855 (neutral) |