RefMet Compound Details
MW structure | 34478 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | 3-O-Acetylecdysone 2-phosphate | |
Systematic name | (22R)-14,22,25-trihydroxy-6-oxo-2beta-(phosphonooxy)-5beta-cholest-7-en-3beta-yl acetate | |
SMILES | C[C@@H]([C@H]1CC[C@]2(C3=CC(=O)[C@@H]4C[C@H]([C@H](C[C@]4(C)[C@H]3CC[C@]12C)OP(=O)(O)O)OC(=O)C)O)[C@@H](CCC(C)(C)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 586.290688 (neutral) |