Base information
| Cat. No. | |
| CAS No. | 168433-86-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H17NO6 |
| Molecular Weight | 259.256 |
| Exact Mass | 259.106 |
| XLogP3 | -1.72722 |
| Mr | 58.9692 |
| PSA | 123.17 |
| Sequence | - |
| Atom number | 35 |
| Bond number | 35 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H](OC/C=C(\C#N)/C)[C@@H]([C@H]([C@@H]1O)O)O |
