Base information
| Cat. No. | |
| CAS No. | 87099-54-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H17NO5 |
| Molecular Weight | 351.353 |
| Exact Mass | 351.111 |
| XLogP3 | 2.256 |
| Mr | 93.56 |
| PSA | 58.51 |
| Sequence | - |
| Atom number | 43 |
| Bond number | 49 |
| Ring number | 7 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | CC1[C@@H]2O[C@]34C=C5OCOC5=CC4=C4C[C@H]1C(=CN=C4C3)C1=C2OCO1 |
