Base information
| Cat. No. | |
| CAS No. | 36951-72-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C72H66N8O12S4 |
| Molecular Weight | 1363.6 |
| Exact Mass | 1362.37 |
| XLogP3 | 10.0838 |
| Mr | 375.495 |
| PSA | 334.14 |
| Sequence | - |
| Atom number | 162 |
| Bond number | 170 |
| Ring number | 13 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | Cc1ccc(cc1)S(=O)(=O)[O-].Cc1ccc(cc1)S(=O)(=O)[O-].Cc1ccc(cc1)S(=O)(=O)[O-].Cc1ccc(cc1)S(=O)(=O)[O-].C[n+]1ccc(cc1)/C/1=C/2\C=CC(=N2)/C(=c\2/cc/c(=C(/C3=N/C(=C(\c4[nH]c1cc4)/c1cc[n+](cc1)C)/C=C3)\c1cc[n+](cc1)C)/[nH]2)/c1cc[n+](cc1)C |
