Base information
| Cat. No. | |
| CAS No. | 8003-69-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C36H23N8Na3O11S3 |
| Molecular Weight | 908.779 |
| Exact Mass | 908.034 |
| XLogP3 | 12.0851 |
| Mr | 207.691 |
| PSA | 363.4 |
| Sequence | - |
| Atom number | 84 |
| Bond number | 87 |
| Ring number | 7 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | Nc1ccc2c(c1)c(O)c(c(c2)S(=O)(=O)[O-])/N=N/c1ccc2c(c1)c(O)c(c(c2)S(=O)(=O)[O-])/N=N/c1ccc(cc1)/N=N/c1ccc(c2c1ccc(c2)S(=O)(=O)[O-])N.[Na+].[Na+].[Na+] |
