Base information
| Cat. No. | |
| CAS No. | 84563-76-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C23H44N4O17 |
| Molecular Weight | 648.612 |
| Exact Mass | 648.27 |
| XLogP3 | -5.6095 |
| Mr | 137.54 |
| PSA | 386.67 |
| Sequence | - |
| Atom number | 88 |
| Bond number | 89 |
| Ring number | 3 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CCC(C(=O)O)N.OC[C@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@H]([C@@H]([C@H]2O)N)O)[C@@H]([C@H]([C@@H]1O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1N)O)O)O)N |
