Base information
| Cat. No. | |
| CAS No. | 129418-54-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C64H81N17O14 |
| Molecular Weight | 1312.43 |
| Exact Mass | 1311.61 |
| XLogP3 | 3.099 |
| Mr | 351.164 |
| PSA | 484.63 |
| Sequence | - |
| Atom number | 176 |
| Bond number | 183 |
| Ring number | 8 |
| Rotor number | 42 |
| Residues number | 0 |
| Canonical smiles | OC[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)O)CCCN=C(N)N)CC(C)C)Cc1c[nH]c2c1cccc2)Cc1ccc(cc1)O)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1)Cc1[nH]cnc1 |
