Base information
| Cat. No. | |
| CAS No. | 157380-72-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C45H51N9Na2O11S |
| Molecular Weight | 971.985 |
| Exact Mass | 971.322 |
| XLogP3 | 0.1077 |
| Mr | 266.409 |
| PSA | 322.44 |
| Sequence | - |
| Atom number | 119 |
| Bond number | 122 |
| Ring number | 6 |
| Rotor number | 13 |
| Residues number | 0 |
| Canonical smiles | CC(C[C@@H]1NC(=O)[C@H](NC(=O)[C@H](CC(=O)[O-])NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](NC1=O)Cc1c[nH]c2c1cccc2)CC(=O)[O-])CC(=O)N1CCN(CC1)c1ccccc1)c1cccs1)C.[Na+].[Na+] |
