Base information
| Cat. No. | |
| CAS No. | 72229-42-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H29NO11 |
| Molecular Weight | 423.412 |
| Exact Mass | 423.174 |
| XLogP3 | -3.68062 |
| Mr | 91.8646 |
| PSA | 202.32 |
| Sequence | - |
| Atom number | 58 |
| Bond number | 59 |
| Ring number | 2 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](O[C@@](C#N)(CC)C)[C@@H]([C@H]([C@@H]2O)O)O)[C@@H]([C@H]([C@@H]1O)O)O |