Base information
| Cat. No. | |
| CAS No. | 80035-32-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H21NO7 |
| Molecular Weight | 399.394 |
| Exact Mass | 399.132 |
| XLogP3 | 0.2449 |
| Mr | 103.591 |
| PSA | 116.53 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 53 |
| Ring number | 4 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | OCC1O[C@@H](OCc2ccccc2)C(C([C@@H]1O)O)N1C(=O)c2c(C1=O)cccc2 |
