Base information
| Cat. No. | |
| CAS No. | 1613530-18-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H18N2O6 |
| Molecular Weight | 298.292 |
| Exact Mass | 298.116 |
| XLogP3 | -1.8994 |
| Mr | 71.5421 |
| PSA | 124.78 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 41 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)c1cn(CC2CC2)c(=O)[nH]c1=O |
