Base information
| Cat. No. | |
| CAS No. | 1420-36-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C25H43N7Na3O21P3S |
| Molecular Weight | 971.599 |
| Exact Mass | 971.114 |
| XLogP3 | 1.1285 |
| Mr | 186.876 |
| PSA | 471.61 |
| Sequence | - |
| Atom number | 103 |
| Bond number | 99 |
| Ring number | 3 |
| Rotor number | 24 |
| Residues number | 0 |
| Canonical smiles | O=C(NCCSC(=O)CC(=O)C)CCNC(=O)[C@@H](C(COP(=O)(OP(=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1OP(=O)(O)[O-])O)n1cnc2c1ncnc2N)[O-])[O-])(C)C)O.[Na+].[Na+].[Na+].O.O.O |
