Base information
| Cat. No. | |
| CAS No. | 499-30-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H21NO9S2 |
| Molecular Weight | 423.459 |
| Exact Mass | 423.066 |
| XLogP3 | 0.366 |
| Mr | 96.379 |
| PSA | 199.79 |
| Sequence | - |
| Atom number | 48 |
| Bond number | 49 |
| Ring number | 2 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H](S/N=C(/OS(=O)(=O)O)\CCc2ccccc2)[C@@H]([C@H]([C@@H]1O)O)O |
