Showing RIpred-Card for PS(16:0/20:5(5Z,8Z,11Z,14Z,16E)-OH(18)) (RI01663877)

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 IDRI01663877
Compound Identification
Common NamePS(16:0/20:5(5Z,8Z,11Z,14Z,16E)-OH(18))
Structure
Average Molecular Weight797.4843
SMILES[H][C@@](COC(=O)CCCCCCCCCCCCCCC)(COP(O)(=O)OC[C@H](N)C(O)=O)OC(=O)CCC\C=C/C\C=C/C\C=C/C=C/CC(O)\C=C/CC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5880.4697
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices