Base information
| Cat. No. | |
| CAS No. | 210905-12-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C134H189N37O39 |
| Molecular Weight | 2942.16 |
| Exact Mass | 2940.39 |
| XLogP3 | 1.2093 |
| Mr | 750.303 |
| PSA | 1221.95 |
| Sequence | - |
| Atom number | 399 |
| Bond number | 407 |
| Ring number | 9 |
| Rotor number | 116 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=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)O)C)CCCNC(=N)N)Cc1ccc(cc1)O)Cc1ccc(cc1)O)CCCNC(=N)N)CC(=O)O)Cc1nc[nH]c1)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)N)C)CC(=O)O)Cc1ccccc1)CO)Cc1ccccc1)CC(C)C)CCC(=O)N)CCC(=O)N)CCC(=O)O |