rel-(10xi,13xi,14xi)-3-hydroxy-8xi,9xi-16,17-epoxypregn-5-en-20-one
Chemical Structure Depiction of
rel-(10xi,13xi,14xi)-3-hydroxy-8xi,9xi-16,17-epoxypregn-5-en-20-one
rel-(10xi,13xi,14xi)-3-hydroxy-8xi,9xi-16,17-epoxypregn-5-en-20-one
Compound characteristics
| Compound ID: | N017-0007 |
| Compound Name: | rel-(10xi,13xi,14xi)-3-hydroxy-8xi,9xi-16,17-epoxypregn-5-en-20-one |
| Molecular Weight: | 330.47 |
| Molecular Formula: | C21 H30 O3 |
| Smiles: | CC([C@@]12[C@@H](CC3C4CC=C5CC(CCC5(C)C4CCC13C)O)O2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2202 |
| logD: | 3.2202 |
| logSw: | -4.2908 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.003 |
| InChI Key: | UQVIXFCYKBWZPJ-UHFFFAOYSA-N |