Base information
| Cat. No. | |
| CAS No. | 383417-46-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H25NO12 |
| Molecular Weight | 447.391 |
| Exact Mass | 447.138 |
| XLogP3 | -1.8515 |
| Mr | 100.631 |
| PSA | 204.12 |
| Sequence | - |
| Atom number | 56 |
| Bond number | 58 |
| Ring number | 3 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H](Oc2ccc(cc2)[N+](=O)[O-])[C@@H]([C@H]([C@H]1O)O)O[C@@H]1O[C@@H](C)[C@H]([C@H]([C@@H]1O)O)O |