Base information
| Cat. No. | |
| CAS No. | 28244-94-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H26O9S |
| Molecular Weight | 454.491 |
| Exact Mass | 454.13 |
| XLogP3 | 2.1702 |
| Mr | 109.731 |
| PSA | 139.73 |
| Sequence | - |
| Atom number | 57 |
| Bond number | 58 |
| Ring number | 2 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | CC(=O)OC[C@H]1O[C@@H](Sc2ccc(cc2)C)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C |