Base information
| Cat. No. | |
| CAS No. | 3599-32-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C43H49N2NaO6S2 |
| Molecular Weight | 776.979 |
| Exact Mass | 776.293 |
| XLogP3 | 11.0108 |
| Mr | 226.948 |
| PSA | 134.58 |
| Sequence | - |
| Atom number | 103 |
| Bond number | 107 |
| Ring number | 6 |
| Rotor number | 14 |
| Residues number | 0 |
| Canonical smiles | CC1(C)c2c3ccccc3ccc2[N+](=C1C=CC=CC=CC=C1N(CCCCS(=O)(=O)O)c2c(C1(C)C)c1ccccc1cc2)CCCCS(=O)(=O)[O-].[NaH] |
