Base information
| Cat. No. | |
| CAS No. | 206645-99-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C66H99N23O17S2 |
| Molecular Weight | 1550.77 |
| Exact Mass | 1549.7 |
| XLogP3 | 1.4026 |
| Mr | 430.481 |
| PSA | 704.58 |
| Sequence | - |
| Atom number | 207 |
| Bond number | 211 |
| Ring number | 5 |
| Rotor number | 28 |
| Residues number | 0 |
| Canonical smiles | CC[C@@H]([C@@H](C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc2nc[nH]c2)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)C(C)C)C(C)C)CCC(=O)N)CC(=O)O)Cc1c[nH]c2c1cccc2)Cc1nc[nH]c1)C(=O)N[C@H](C(=O)N)[C@H](O)C)N)C |
