Base information
| Cat. No. | |
| CAS No. | 172605-95-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H13N3O6 |
| Molecular Weight | 259.216 |
| Exact Mass | 259.08 |
| XLogP3 | -3.0668 |
| Mr | 56.9091 |
| PSA | 137.67 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H]([C@]([C@@H]1O)(C)O)n1ncc(=O)[nH]c1=O |
