RefMet Compound Details
MW structure | 69132 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Haplophytine | |
Systematic name | 6-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-2-one | |
SMILES | CN1CC[C@@]2(c3cccc(c3N3C(=O)CC[C@]13C2=O)O)c1cc2c(c(c1OC)OC)N(C)[C@@H]1C=C[C@]34CCCN5CC[C@@]21[C@@]45OC(=O)C3 Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 652.289701 (neutral) |