Base information
| Cat. No. | |
| CAS No. | 120085-63-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H15NO7 |
| Molecular Weight | 297.261 |
| Exact Mass | 297.085 |
| XLogP3 | 0.21918 |
| Mr | 66.706 |
| PSA | 111.92 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 36 |
| Ring number | 1 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | N#CC1=C[C@H]([C@@H]([C@H](O1)COC(=O)C)OC(=O)C)OC(=O)C |
