Base information
| Cat. No. | |
| CAS No. | 100929-71-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C27H43N8O17P3 |
| Molecular Weight | 844.595 |
| Exact Mass | 844.196 |
| XLogP3 | 0.6281 |
| Mr | 187.705 |
| PSA | 419.6 |
| Sequence | - |
| Atom number | 98 |
| Bond number | 102 |
| Ring number | 6 |
| Rotor number | 13 |
| Residues number | 0 |
| Canonical smiles | O[C@@H]1[C@H](O)[C@H](O[C@H]1N1C=CCC(=C1)C(=O)N)COP(=O)(OP(=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)OP(=O)(O)O)n1cnc2c1ncnc2N)O)O.NC1CCCCC1 |