RefMet Compound Details
MW structure | 35215 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Digitoxigenin | |
Systematic name | 3-beta,14beta-dihydroxy-5-beta-card-20(22)-enolide | |
SMILES | C[C@]12CC[C@@H](C[C@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@H](CC[C@]12O)C1=CC(=O)OC1)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Sum Composition | ST 23:3;O4 | View other entries in RefMet with this sum composition |
Exact mass | 374.245710 (neutral) |