Base information
| Cat. No. | |
| CAS No. | 849479-74-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C59H74N12O11S2 |
| Molecular Weight | 1191.42 |
| Exact Mass | 1190.5 |
| XLogP3 | 6.6292 |
| Mr | 340.678 |
| PSA | 438.54 |
| Sequence | - |
| Atom number | 158 |
| Bond number | 163 |
| Ring number | 7 |
| Rotor number | 20 |
| Residues number | 0 |
| Canonical smiles | CC(=O)O.NCCCC[C@@H]1NC(=O)[C@H](NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@H](NC1=O)C(C)C)C(=O)N[C@H](C(=O)N)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](Cc1ccccc1)N)Cc1c[nH]c2c1cccc2 |
