RefMet Compound Details
MW structure | 70661 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Trichilin A | |
Systematic name | (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(1S,2R)-2-hydroxyindan-1-yl]amino]-5-oxo-pentyl]-N-tert-butyl-4-(3-pyridylmethyl)piperazine-2-carboxamide;sulfuric acid | |
SMILES | CC[C@@H](C)C(=O)OC1[C@]2(C)[C@@H]3C[C@H]([C@]4(C)[C@H](C(=O)[C@H]([C@@]5(C)[C@@H](C[C@@H]6[C@]45O6)c4ccoc4)O)[C@@]3(CO1)[C@H]([C@H]([C@H]2OC(=O)C)OC(=O)C)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 674.293845 (neutral) |