Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00020310
Compound Identification
Common Name17-Hydroxypregnenolone sulfate,1TBDMS,isomer#3
Structure
Average Molecular Weight526.2784
SMILESC=C(O[Si](C)(C)C(C)(C)C)[C@@]1(O)CC[C@H]2[C@@H]3CC=C4CC(OS(=O)(=O)O)CC[C@]4(C)[C@H]3CC[C@@]21C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3589.2742
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices