RefMet Compound Details
MW structure | 70851 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Spiredine | |
Systematic name | (2S)-5-carboxy-1-[(2E)-2-[(2S)-2,6-dicarboxy-2,3-dihydro-1H-pyridin-4-ylidene]ethylidene]-7-oxo-2,3-dihydropyrano[3,4-b]pyrrol-1-ium-2-carboxylate | |
SMILES | C=C1C[C@]23CC(=O)[C@@H]4[C@@]5(C)CCC[C@]64[C@@H]3C(=O)[C@@H]1CC2[C@H]6N1CCOC51 Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 353.199094 (neutral) |