Base information
| Cat. No. | |
| CAS No. | 7177-50-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H25N2NaO6S |
| Molecular Weight | 456.488 |
| Exact Mass | 456.133 |
| XLogP3 | 2.8608 |
| Mr | 118.236 |
| PSA | 130.47 |
| Sequence | - |
| Atom number | 56 |
| Bond number | 57 |
| Ring number | 4 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCOc1ccc2c(c1C(=O)N[C@@H]1C(=O)N3[C@@H]1SC([C@@H]3C(=O)O)(C)C)cccc2.[NaH].O |
