RefMet Compound Details
MW structure | 68894 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Columbiananine | |
Systematic name | (2S,3R,4S,5R,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chromenylium-3-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | |
SMILES | CCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]5C[C@@H]6[C@H](C[C@]([C@@H](C[C@H]23)C14)([C@H]5[C@H]6O)O)OC)OC)CO Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 407.267174 (neutral) |