Base information
| Cat. No. | |
| CAS No. | 1544300-84-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C152H222N38O50 |
| Molecular Weight | 3381.61 |
| Exact Mass | 3379.6 |
| XLogP3 | 0.2534 |
| Mr | 842.482 |
| PSA | 1448.19 |
| Sequence | - |
| Atom number | 462 |
| Bond number | 468 |
| Ring number | 7 |
| Rotor number | 138 |
| 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)NC(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)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)[C@H](O)C)CO)CCC(=O)O)CC(C)C)Cc1c[nH]c2c1cccc2)CCCCN)C(C)C)Cc1ccccc1)CCC(=O)O)CCC(=O)O)C)CCCNC(=N)N)C)(C)C)CC(=O)O)CC(C)C)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1cnc[nH]1)N)CO)CCC(=O)N)Cc1ccccc1)CO)CC(=O)O)Cc1ccc(cc1)O)CO |