Base information
| Cat. No. | |
| CAS No. | 219931-45-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H25N7O7S |
| Molecular Weight | 459.477 |
| Exact Mass | 459.154 |
| XLogP3 | 0.5319 |
| Mr | 106.112 |
| PSA | 226.18 |
| Sequence | - |
| Atom number | 56 |
| Bond number | 58 |
| Ring number | 3 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | CC[C@@H]([C@@H](C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N)N)C |
