Base information
| Cat. No. | |
| CAS No. | 220476-38-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C38H52N2O9S |
| Molecular Weight | 712.892 |
| Exact Mass | 712.339 |
| XLogP3 | 10.6652 |
| Mr | 195.606 |
| PSA | 167.95 |
| Sequence | - |
| Atom number | 102 |
| Bond number | 103 |
| Ring number | 3 |
| Rotor number | 22 |
| Residues number | 0 |
| Canonical smiles | COc1cc(O)c(cc1S(=O)(=O)[O-])C(=O)c1ccccc1.CCCCCCOc1cc(OCCCCCC)c(c(c1)OCCCCCC)[N+]#N |
