rel-(8xi,9xi,14xi)-cholest-5-en-3-yl 3,4,4-trichlorobut-3-enoate
Chemical Structure Depiction of
rel-(8xi,9xi,14xi)-cholest-5-en-3-yl 3,4,4-trichlorobut-3-enoate
rel-(8xi,9xi,14xi)-cholest-5-en-3-yl 3,4,4-trichlorobut-3-enoate
Compound characteristics
Compound ID: | 8015-7724 |
Compound Name: | rel-(8xi,9xi,14xi)-cholest-5-en-3-yl 3,4,4-trichlorobut-3-enoate |
Molecular Weight: | 558.07 |
Molecular Formula: | C31 H47 Cl3 O2 |
Smiles: | CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(CC(=C([Cl])[Cl])[Cl])=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 9.3223 |
logD: | 9.3223 |
logSw: | -6.6408 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 20.1266 |
InChI Key: | LALVLLURTKMNQI-VLXLJAAWSA-N |