rel-(8xi,9xi,10xi,13xi,14xi)-3,17-dihydroxy-16-methylpregnan-20-one
Chemical Structure Depiction of
rel-(8xi,9xi,10xi,13xi,14xi)-3,17-dihydroxy-16-methylpregnan-20-one
rel-(8xi,9xi,10xi,13xi,14xi)-3,17-dihydroxy-16-methylpregnan-20-one
Compound characteristics
| Compound ID: | N017-0012 |
| Compound Name: | rel-(8xi,9xi,10xi,13xi,14xi)-3,17-dihydroxy-16-methylpregnan-20-one |
| Molecular Weight: | 348.53 |
| Molecular Formula: | C22 H36 O3 |
| Smiles: | [H][C@]12CCC3C(CCC4(C)C3C[C@@H](C)[C@@]4(C(C)=O)O)C2(C)CC[C@@H](C1)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5281 |
| logD: | 3.5281 |
| logSw: | -4.3515 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45 |
| InChI Key: | RGHGKGRVFXQGOV-JHPBCVOQSA-N |