Base information
| Cat. No. | |
| CAS No. | 10169-29-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C42H24N2Na6O24S6 |
| Molecular Weight | 1270.97 |
| Exact Mass | 1269.84 |
| XLogP3 | 13.4492 |
| Mr | 263.528 |
| PSA | 463.46 |
| Sequence | - |
| Atom number | 104 |
| Bond number | 108 |
| Ring number | 11 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | OS(=O)(=O)Oc1c2ccc3c(c2c(c2c1c1[nH]c4c(c1cc2)ccc1c4c(OS(=O)(=O)O)c2ccccc2c1OS(=O)(=O)O)OS(=O)(=O)O)[nH]c1c3ccc2c1c(OS(=O)(=O)O)c1ccccc1c2OS(=O)(=O)O.[Na].[Na].[Na].[Na].[Na].[Na] |
