Base information
| Cat. No. | |
| CAS No. | 1258-71-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H18N6O12 |
| Molecular Weight | 474.336 |
| Exact Mass | 474.098 |
| XLogP3 | -3.2016 |
| Mr | 101.921 |
| PSA | 272.19 |
| Sequence | - |
| Atom number | 51 |
| Bond number | 51 |
| Ring number | 1 |
| Rotor number | 15 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CN(c1nc(nc(n1)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O)CC(=O)O |
