Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01723896
Compound Identification
Common NameNordeoxycholic acid,3TBDMS,isomer#1
Structure
Average Molecular Weight720.5364
SMILESCC(CC(=O)O[Si](C)(C)C(C)(C)C)C1CCC2C3CCC4CC(O[Si](C)(C)C(C)(C)C)CCC4(C)C3CC(O[Si](C)(C)C(C)(C)C)C12C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3796.2224
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices