Base information
| Cat. No. | |
| CAS No. | 12772-56-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H19LiO13 |
| Molecular Weight | 498.319 |
| Exact Mass | 498.099 |
| XLogP3 | -2.5288 |
| Mr | 110.443 |
| PSA | 245.34 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 57 |
| Ring number | 4 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H]([C@@H]([C@H]([C@@H]1O)O)O)c1c(O)c2c(c(c1O)O)C(=O)c1c(C2=O)c(C)c(c(c1)O)C(=O)[O-].[Li+] |
