Energies of the sulfated products of 22R and 22S epimers of budesonide
| Molecule | Energy |
|---|---|
| kcals/mol | |
| Budesonide − 22R | 30.55 |
| Budesonide − 22R, 11 sulfate | 25.58 |
| Budesonide − 22R, 21 sulfate | 21.17 |
| Budesonide − 22S | 30.84 |
| Budesonide − 22S, 11 sulfate | 26.03 |
| Budesonide − 22S, 21 sulfate | 20.62 |
SYBYL version 6.4 molecular modeling package was used for all modeling procedures.