Base information
| Cat. No. | |
| CAS No. | 68353-55-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H21NO7 |
| Molecular Weight | 399.394 |
| Exact Mass | 399.132 |
| XLogP3 | 2.5167 |
| Mr | 105.407 |
| PSA | 86.69 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 54 |
| Ring number | 5 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1c2c(CCN([C@H]2[C@H]2OC(=O)c3c2ccc(c3O)OC)C)cc2c1OCO2 |
