Base information
| Cat. No. | |
| CAS No. | 25759-28-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C102H154N30O33S4 |
| Molecular Weight | 2456.76 |
| Exact Mass | 2455.02 |
| XLogP3 | 0.9288 |
| Mr | 612.122 |
| PSA | 1186.8 |
| Sequence | - |
| Atom number | 323 |
| Bond number | 326 |
| Ring number | 4 |
| Rotor number | 98 |
| Residues number | 0 |
| Canonical smiles | NCC(=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)N1CCC[C@H]1C(=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)CC(=O)N)CS)Cc1ccc(cc1)O)CC(=O)N)CCC(=O)N)CC(C)C)CC(=O)O)Cc1ccccc1)[C@H](CC)C)CC(=O)O)CS)CCCNC(=N)N)Cc1c[nH]cn1)CS)CS)CCC(=O)N)CC(=O)O)C(C)C)[C@H](CC)C |