Base information
| Cat. No. | |
| CAS No. | 732286-09-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C94H143N27O25 |
| Molecular Weight | 2051.31 |
| Exact Mass | 2050.07 |
| XLogP3 | 1.9545 |
| Mr | 558.589 |
| PSA | 831.57 |
| Sequence | - |
| Atom number | 289 |
| Bond number | 294 |
| Ring number | 6 |
| Rotor number | 59 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1[nH]cnc1)NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H]1CCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCNC(=N)N)Cc1ccc(cc1)O)C(C)C)CC(C)C)CO)CC(=O)N |
