Base information
| Cat. No. | |
| CAS No. | 137391-68-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H18N4O7 |
| Molecular Weight | 390.347 |
| Exact Mass | 390.118 |
| XLogP3 | 0.94246 |
| Mr | 99.3995 |
| PSA | 175.91 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 47 |
| Ring number | 2 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | [N-]=[N+]=C(C(=O)[C@@H]([C@H]1NC(=O)[C@@H]1[C@H](O)C)C)C(=O)OCc1ccc(cc1)[N+](=O)[O-] |
