Base information
| Cat. No. | |
| CAS No. | 125911-68-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C74H131N29O18S2 |
| Molecular Weight | 1779.15 |
| Exact Mass | 1777.97 |
| XLogP3 | 2.3722 |
| Mr | 456.271 |
| PSA | 830.86 |
| Sequence | - |
| Atom number | 254 |
| Bond number | 255 |
| Ring number | 2 |
| Rotor number | 79 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCNC(=N)N)CCCNC(=N)N)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=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](Cc1nc[nH]c1)N)CCSC)CCCNC(=N)N)CO)C)CCSC)CO)CC(C)C)Cc1nc[nH]c1)CC(C)C |
