Base information
| Cat. No. | |
| CAS No. | 107902-86-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C71H106N16O31 |
| Molecular Weight | 1679.69 |
| Exact Mass | 1678.72 |
| XLogP3 | -3.0101 |
| Mr | 406.173 |
| PSA | 763.65 |
| Sequence | - |
| Atom number | 224 |
| Bond number | 226 |
| Ring number | 3 |
| Rotor number | 69 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)N)CO)CCC(=O)O)CCC(=O)O)CO)CC(=O)O)Cc1ccccc1)CCC(=O)O)CCC(=O)O)CC(C)C)CCC(=O)O |
