Base information
| Cat. No. | |
| CAS No. | 101687-28-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H25NO6 |
| Molecular Weight | 351.394 |
| Exact Mass | 351.168 |
| XLogP3 | 1.0201 |
| Mr | 95.2978 |
| PSA | 102.26 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 52 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1O[C@@H]2CC[N+]3([C@@H]2C(=CC3)COC(=O)[C@]([C@@H]([C@H](C1=C)C)C)(C)O)[O-] |
