Base information
| Cat. No. | |
| CAS No. | 61891-87-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H22N2O10 |
| Molecular Weight | 426.375 |
| Exact Mass | 426.127 |
| XLogP3 | 0.973 |
| Mr | 100.337 |
| PSA | 166.21 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 53 |
| Ring number | 2 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | CC(=O)N[C@H]1[C@@H](O[C@@H]([C@H]([C@@H]1OC(=O)C)O)COC(=O)C)Oc1ccc(cc1)[N+](=O)[O-] |
