RefMet Compound Details
MW structure | 145771 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Lubiprostone | |
Systematic name | 7-[(2R,4aR,5S,7aR)-2-(1,1-difluoropentyl)-2-hydroxy-6-oxo-octahydrocyclopenta[b]pyran-5-yl]heptanoic acid | |
SMILES | CCCCC([C@]1(CC[C@@H]2[C@@H](CCCCCCC(=O)O)C(=O)C[C@H]2O1)O)(F)F Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 390.221781 (neutral) |