Base information
| Cat. No. | |
| CAS No. | 1449-61-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H28O4 |
| Molecular Weight | 344.445 |
| Exact Mass | 344.199 |
| XLogP3 | 3.629 |
| Mr | 95.296 |
| PSA | 60.44 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 56 |
| Ring number | 4 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(=O)O[C@H]1CC[C@]2(C(=CC(=O)[C@@H]3[C@@H]2CC[C@]2([C@H]3CCC2=O)C)C1)C |
