Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00018888
Compound Identification
Common Name17a-Hydroxypregnenolone,3TMS,isomer#1
Structure
Average Molecular Weight548.3537
SMILESC=C(O[Si](C)(C)C)[C@@]1(O[Si](C)(C)C)CC[C@H]2[C@@H]3CC=C4C[C@@H](O[Si](C)(C)C)CC[C@]4(C)[C@H]3CC[C@@]21C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index2964.5356
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices