Base information
| Cat. No. | |
| CAS No. | 52-39-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H28O5 |
| Molecular Weight | 360.444 |
| Exact Mass | 360.194 |
| XLogP3 | 1.8457 |
| Mr | 96.5346 |
| PSA | 91.67 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 57 |
| Ring number | 4 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OCC(=O)[C@H]1CC[C@@H]2[C@]1(C=O)C[C@H](O)[C@H]1[C@H]2CCC2=CC(=O)CC[C@]12C |
