Base information
| Cat. No. | |
| CAS No. | 18842-98-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H24O12S |
| Molecular Weight | 464.441 |
| Exact Mass | 464.099 |
| XLogP3 | -1.8394 |
| Mr | 101.451 |
| PSA | 217.74 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 57 |
| Ring number | 3 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H](O[C@@H]2OC=C([C@@H]3[C@H]2C(=C[C@@H]3O)COC(=O)SC)C(=O)O)[C@@H]([C@H]([C@@H]1O)O)O |
