Base information
| Cat. No. | |
| CAS No. | 1629655-94-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C93H118N16O19S |
| Molecular Weight | 1796.09 |
| Exact Mass | 1794.85 |
| XLogP3 | 5.7377 |
| Mr | 532.87 |
| PSA | 525.39 |
| Sequence | - |
| Atom number | 247 |
| Bond number | 254 |
| Ring number | 8 |
| Rotor number | 24 |
| Residues number | 0 |
| Canonical smiles | CCCC[C@H]1C(=O)N(C)CC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccc(cc2)O)C(=O)N(C)CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSCC(=O)N[C@H](C(=O)N([C@H](C(=O)N1C)Cc1ccccc1)C)Cc1ccccc1)C(=O)NCC(=O)N)CC(C)C)Cc1ccc(cc1)O)Cc1c[nH]c2c1cccc2 |
