RefMet Compound Details
MW structure | 68289 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Haemocorin | |
Systematic name | 2-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-6-hydroxy-5-methoxy-9-phenyl-phenalen-1-one | |
SMILES | COc1cc2C=C(C(=O)c3c(ccc(c23)c1O)c1ccccc1)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 642.194860 (neutral) |