Base information
| Cat. No. | |
| CAS No. | 208940-40-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C36H58N6O14S |
| Molecular Weight | 830.943 |
| Exact Mass | 830.373 |
| XLogP3 | 1.9877 |
| Mr | 206.078 |
| PSA | 362.6 |
| Sequence | - |
| Atom number | 115 |
| Bond number | 115 |
| Ring number | 1 |
| Rotor number | 31 |
| Residues number | 0 |
| Canonical smiles | CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CS)CC1CCCCC1)NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)C)CC(=O)O)CC(C(=O)O)C(=O)O)CC(C)C)C |
