Base information
| Cat. No. | |
| CAS No. | 24345-16-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C79H131N31O24S4 |
| Molecular Weight | 2027.34 |
| Exact Mass | 2025.89 |
| XLogP3 | -0.3154 |
| Mr | 552.211 |
| PSA | 1021.52 |
| Sequence | - |
| Atom number | 269 |
| Bond number | 272 |
| Ring number | 4 |
| Rotor number | 40 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H]1NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N2)CC(=O)N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]2N(C(=O)[C@@H](NC1=O)C)CCC2)CCC(=O)O)[C@H](O)C)C)CC(C)C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1cnc[nH]1)CCC(=O)N)CCC(=O)N |