Base information
| Cat. No. | |
| CAS No. | 128270-60-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C98H138N24O33 |
| Molecular Weight | 2180.29 |
| Exact Mass | 2178.99 |
| XLogP3 | 0.5432 |
| Mr | 550.222 |
| PSA | 901.57 |
| Sequence | - |
| Atom number | 293 |
| Bond number | 298 |
| Ring number | 6 |
| Rotor number | 86 |
| Residues number | 0 |
| Canonical smiles | CC[C@@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)Cc1ccc(cc1)O)CCC(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)N)CCCNC(=N)N)CC(=O)N)Cc1ccccc1)CCC(=O)O)CCC(=O)O)C |