Base information
| Cat. No. | |
| CAS No. | 128420-44-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C35H42O21 |
| Molecular Weight | 798.695 |
| Exact Mass | 798.222 |
| XLogP3 | -2.0153 |
| Mr | 177.142 |
| PSA | 299.03 |
| Sequence | - |
| Atom number | 98 |
| Bond number | 102 |
| Ring number | 5 |
| Rotor number | 16 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H](Oc2cccc(c2O)C(=O)O[C@@H]2[C@@H](COC(=O)C)O[C@H]([C@@H]([C@H]2OC(=O)C)OC(=O)C)O[C@@H]2OC=C3[C@@]([C@H]2C=C)(O)CCOC3=O)[C@@H]([C@H]([C@@H]1O)O)O |
