Base information
| Cat. No. | |
| CAS No. | 77714-20-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C46H66N14O9S |
| Molecular Weight | 991.17 |
| Exact Mass | 990.486 |
| XLogP3 | 2.9596 |
| Mr | 260.059 |
| PSA | 374.34 |
| Sequence | - |
| Atom number | 136 |
| Bond number | 139 |
| Ring number | 4 |
| Rotor number | 36 |
| Residues number | 0 |
| Canonical smiles | CSCC[C@@H](C(=O)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C)C)CC(C)C |
