Base information
| Cat. No. | |
| CAS No. | 1180-95-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C26H44NNaO6S |
| Molecular Weight | 521.685 |
| Exact Mass | 521.279 |
| XLogP3 | 4.5264 |
| Mr | 132.13 |
| PSA | 135.14 |
| Sequence | - |
| Atom number | 79 |
| Bond number | 81 |
| Ring number | 4 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCCS(=O)(=O)[O-])C)C)C.[Na+] |
