Base information
| Cat. No. | |
| CAS No. | 85643-76-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H22O5 |
| Molecular Weight | 318.364 |
| Exact Mass | 318.147 |
| XLogP3 | 1.2854 |
| Mr | 82.0368 |
| PSA | 80.67 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 48 |
| Ring number | 4 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | CC1=CC(=O)[C@]2([C@H]1CC(=O)[C@@]1([C@@H]2[C@@H](O)[C@H]2[C@@H]([C@@H]1C(=O)O2)C)C)C |
