Base information
| Cat. No. | |
| CAS No. | 6233-83-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C45H70N12O14S2 |
| Molecular Weight | 1067.24 |
| Exact Mass | 1066.46 |
| XLogP3 | 1.6472 |
| Mr | 289.964 |
| PSA | 487.43 |
| Sequence | - |
| Atom number | 143 |
| Bond number | 144 |
| Ring number | 3 |
| Rotor number | 20 |
| Residues number | 0 |
| Canonical smiles | CC(=O)O.CC[C@@H](C1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@@H](N)CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)C |
