Base information
| Cat. No. | |
| CAS No. | 12222-60-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C48H33N8NaO18S6 |
| Molecular Weight | 1225.2 |
| Exact Mass | 1224.01 |
| XLogP3 | 14.2945 |
| Mr | 287.923 |
| PSA | 462.64 |
| Sequence | - |
| Atom number | 114 |
| Bond number | 122 |
| Ring number | 10 |
| Rotor number | 14 |
| Residues number | 0 |
| Canonical smiles | OS(=O)(=O)c1cc(/N=N/c2ccc(c(c2)S(=O)(=O)O)C=Cc2ccc(cc2S(=O)(=O)O)n2nc3c(n2)c2ccccc2c(c3)S(=O)(=O)O)ccc1C=Cc1ccc(cc1S(=O)(=O)O)n1nc2c(n1)c1ccccc1c(c2)S(=O)(=O)O.[NaH] |
