RefMet Compound Details
MW structure | 71588 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Diacetoxyscirpenol | |
Systematic name | [(1S,2R,7R,9R,10R,11S,12R)-11-acetyloxy-10-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-yl]methylacetate | |
SMILES | CC1=C[C@@H]2[C@@](CC1)(COC(=O)C)[C@@]1(C)[C@@H]([C@H]([C@H]([C@@]31CO3)O2)O)OC(=O)C Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 366.167855 (neutral) |