Base information
| Cat. No. | |
| CAS No. | 51-40-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H17NO9 |
| Molecular Weight | 319.265 |
| Exact Mass | 319.09 |
| XLogP3 | -1.3324 |
| Mr | 71.3394 |
| PSA | 201.77 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 38 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | O[C@H]([C@H](C(=O)O)O)C(=O)O.NC[C@@H](c1ccc(c(c1)O)O)O |
