Base information
| Cat. No. | |
| CAS No. | 41945-48-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C28H47N2NaO8S |
| Molecular Weight | 594.736 |
| Exact Mass | 594.295 |
| XLogP3 | 3.0043 |
| Mr | 145.907 |
| PSA | 184.47 |
| Sequence | - |
| Atom number | 87 |
| Bond number | 89 |
| Ring number | 4 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | O[C@@H]1CC[C@]2([C@@H](C1)C[C@H](C1C2C[C@H](O)[C@]2(C1CC[C@@H]2[C@@H](CCC(=O)NCC(=O)NCCS(=O)(=O)[O-])C)C)O)C.[Na+] |
