Base information
| Cat. No. | |
| CAS No. | 50729-97-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H24ClNO9 |
| Molecular Weight | 457.859 |
| Exact Mass | 457.114 |
| XLogP3 | 1.7658 |
| Mr | 106.263 |
| PSA | 126.46 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 56 |
| Ring number | 2 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | CC(=O)OC[C@H]1O[C@@H](Oc2ccc(cc2)Cl)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)NC(=O)C |
