Showing RIpred-Card for 3b,7b,12a-Trihydroxy-5b-cholanoic acid,2TBDMS,isomer#3 (RI00019730)

Jump To Section:
IdentificationPhysical propertiesReferencesXML
Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00019730
Compound Identification
Common Name3b,7b,12a-Trihydroxy-5b-cholanoic acid,2TBDMS,isomer#3
Structure
Average Molecular Weight636.4605
SMILESC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@@H](O)CC[C@]4(C)[C@H]3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3838.8474
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices