Base information
| Cat. No. | |
| CAS No. | 57680-55-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H25FeO15- |
| Molecular Weight | 477.174 |
| Exact Mass | 477.054 |
| XLogP3 | -6.4206 |
| Mr | 80.2043 |
| PSA | 281.12 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 52 |
| Ring number | 1 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H](OCC(C(C(C(C(C(=O)O)O)O)O)O)O)[C@@H]([C@H]([C@@H]1O)O)O.[O-]O.[Fe] |
