Base information
| Cat. No. | |
| CAS No. | 1198791-58-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H19NO4 |
| Molecular Weight | 349.38 |
| Exact Mass | 349.131 |
| XLogP3 | 3.7826 |
| Mr | 97.7925 |
| PSA | 75.63 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 47 |
| Ring number | 3 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | C#CC[C@@](C(=O)O)(NC(=O)OCC1c2ccccc2-c2c1cccc2)C |
