Base information
| Cat. No. | |
| CAS No. | 485803-62-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C47H68N12O9S2 |
| Molecular Weight | 1009.25 |
| Exact Mass | 1008.47 |
| XLogP3 | 3.4733 |
| Mr | 289.317 |
| PSA | 397.48 |
| Sequence | - |
| Atom number | 138 |
| Bond number | 142 |
| Ring number | 5 |
| Rotor number | 20 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H]1NC(=O)[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@H](NC1=O)[C@H](O)C)C(=O)N[C@H](C(=O)N)CCCCN)NC(=O)[C@@H]1CCCN1)Cc1c[nH]c2c1cccc2 |
