Base information
| Cat. No. | |
| CAS No. | 31685-80-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H30O4 |
| Molecular Weight | 346.461 |
| Exact Mass | 346.214 |
| XLogP3 | 4.2017 |
| Mr | 97.821 |
| PSA | 52.6 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 57 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | COC(=O)[C@@]1(C)CCC[C@]2([C@H]1CCC(=C)[C@@H]2CCC1=CCOC1=O)C |
