Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01664602
Compound Identification
Common NamePS(20:3(6,8,11)-OH(5)/18:0)
Structure
Average Molecular Weight829.5469
SMILES[H][C@@](COC(=O)CCCC(O)\C=C\C=C\C\C=C\CCCCCCCC)(COP(O)(=O)OC[C@H](N)C(O)=O)OC(=O)CCCCCCCCCCCCCCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5951.116
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices