Base information
| Cat. No. | |
| CAS No. | 62003-27-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H27MgNO16 |
| Molecular Weight | 537.709 |
| Exact Mass | 537.118 |
| XLogP3 | -9.5027 |
| Mr | 103.996 |
| PSA | 332.49 |
| Sequence | - |
| Atom number | 63 |
| Bond number | 60 |
| Ring number | 1 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | c1ccc[nH]1.OC[C@H]([C@@H]([C@H]([C@@H](C(=O)C(=O)[O-])O)O)O)O.OC[C@H]([C@@H]([C@H]([C@@H](C(=O)C(=O)[O-])O)O)O)O.[Mg+2] |