Base information
| Cat. No. | |
| CAS No. | 134248-85-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C147H243N41O31 |
| Molecular Weight | 3080.76 |
| Exact Mass | 3078.87 |
| XLogP3 | 9.9571 |
| Mr | 812.631 |
| PSA | 1259.87 |
| Sequence | - |
| Atom number | 462 |
| Bond number | 466 |
| Ring number | 5 |
| Rotor number | 144 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCCN)CCCCN)CC(=O)N)CCCCN)CCCCN)Cc1ccccc1)CO)Cc1ccccc1)CO)CC(C)C)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@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)N)CCCCN)CCCCN)CCCCN)CCCCN)CCCNC(=N)N)Cc1ccccc1)CO)Cc1ccccc1)CCCCN)CCCCN)CO)Cc1ccccc1 |