Base information
| Cat. No. | |
| CAS No. | 1264-45-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C25H40N7O19P3S |
| Molecular Weight | 867.607 |
| Exact Mass | 867.131 |
| XLogP3 | -0.2516 |
| Mr | 183.901 |
| PSA | 455.66 |
| Sequence | - |
| Atom number | 95 |
| Bond number | 97 |
| Ring number | 3 |
| Rotor number | 24 |
| Residues number | 0 |
| Canonical smiles | O=C(NCCSC(=O)C(C(=O)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 |
