Base information
| Cat. No. | |
| CAS No. | 10344-94-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H13NO9 |
| Molecular Weight | 315.233 |
| Exact Mass | 315.059 |
| XLogP3 | -0.611 |
| Mr | 70.0192 |
| PSA | 162.27 |
| Sequence | - |
| Atom number | 35 |
| Bond number | 36 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC(=O)[C@H]1O[C@@H](Oc2ccc(cc2)[N+](=O)[O-])[C@@H]([C@H]([C@@H]1O)O)O |
