Base information
| Cat. No. | |
| CAS No. | 53016-31-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H29NO2 |
| Molecular Weight | 327.46 |
| Exact Mass | 327.22 |
| XLogP3 | 4.1437 |
| Mr | 97.6473 |
| PSA | 52.82 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 56 |
| Ring number | 4 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O/N=C/1\CC[C@@H]2C(=C1)CC[C@H]1[C@H]2CC[C@@]2([C@@H]1CC[C@]2(O)C#C)CC |
