Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00007642
Compound Identification
Common NameGlycocholic acid
Structure
Average Molecular Weight465.309
SMILESC[C@H](CCC(O)=NCC(O)=O)[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)[C@]12C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3709.2073
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices