Base information
| Cat. No. | |
| CAS No. | 89662-30-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C78H105ClN18O13 |
| Molecular Weight | 1538.23 |
| Exact Mass | 1536.78 |
| XLogP3 | 8.006 |
| Mr | 421.563 |
| PSA | 479.87 |
| Sequence | - |
| Atom number | 215 |
| Bond number | 221 |
| Ring number | 7 |
| Rotor number | 54 |
| Residues number | 0 |
| Canonical smiles | CCNC(=NCC)NCCCC[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(=O)N)C)CCCNC(=N)N)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc2c(c1)cccc2)NC(=O)C)Cc1ccc(cc1)Cl)CO)Cc1ccc(cc1)O |
