Base information
| Cat. No. | |
| CAS No. | 581-05-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C77H109N21O19S |
| Molecular Weight | 1664.88 |
| Exact Mass | 1663.79 |
| XLogP3 | 2.6834 |
| Mr | 432.984 |
| PSA | 668.28 |
| Sequence | - |
| Atom number | 227 |
| Bond number | 232 |
| Ring number | 6 |
| Rotor number | 64 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N)C(C)C)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CO)Cc1ccc(cc1)O)CO)CCSC)CCC(=O)O)Cc1nc[nH]c1)Cc1ccccc1)CCCNC(=N)N |
