Base information
| Cat. No. | |
| CAS No. | 81246-76-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C37H35N3O8 |
| Molecular Weight | 649.689 |
| Exact Mass | 649.242 |
| XLogP3 | 4.2137 |
| Mr | 176.716 |
| PSA | 141.37 |
| Sequence | - |
| Atom number | 83 |
| Bond number | 88 |
| Ring number | 6 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1)C(c1ccc(cc1)OC)(c1ccccc1)OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc(nc1=O)NC(=O)c1ccccc1 |
