Base information
| Cat. No. | |
| CAS No. | 2169-64-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H17N3O9 |
| Molecular Weight | 371.299 |
| Exact Mass | 371.096 |
| XLogP3 | -1.7445 |
| Mr | 81.2757 |
| PSA | 155.88 |
| Sequence | - |
| Atom number | 43 |
| Bond number | 44 |
| Ring number | 2 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | CC(=O)O[C@@H]1[C@H](OC(=O)C)[C@H](O[C@H]1n1ncc(=O)[nH]c1=O)COC(=O)C |
