Base information
| Cat. No. | |
| CAS No. | 1611-35-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C31H32N2O13S |
| Molecular Weight | 672.656 |
| Exact Mass | 672.163 |
| XLogP3 | 2.7486 |
| Mr | 162.768 |
| PSA | 247.89 |
| Sequence | - |
| Atom number | 79 |
| Bond number | 82 |
| Ring number | 4 |
| Rotor number | 14 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CN(Cc1cc(cc(c1O)C)C1(OS(=O)(=O)c2c1cccc2)c1cc(C)c(c(c1)CN(CC(=O)O)CC(=O)O)O)CC(=O)O |
