Base information
| Cat. No. | |
| CAS No. | 433922-67-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C111H149N27O28 |
| Molecular Weight | 2309.53 |
| Exact Mass | 2308.11 |
| XLogP3 | 5.6252 |
| Mr | 606.411 |
| PSA | 883.21 |
| Sequence | - |
| Atom number | 315 |
| Bond number | 324 |
| Ring number | 10 |
| Rotor number | 86 |
| Residues number | 0 |
| Canonical smiles | NCCCC[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)NCC(=O)O)[C@H](CC)C)Cc1c[nH]c2c1cccc2)CCC(=O)O)CCC(=O)O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)CN)Cc1ccc(cc1)O)CO)CCCNC(=N)N)CCC(=O)N |