Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00017476
Compound Identification
Common Name3b-Hydroxy-5-cholenoic acid
Structure
Average Molecular Weight374.2821
SMILES[H][C@@]12CC[C@H]([C@H](C)CCC(O)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@@H](O)CC[C@]12C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3567.5894
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices