Showing RIpred-Card for PS(18:3(6Z,9Z,12Z)/20:5(5Z,8Z,10E,14Z,17Z)-OH(12)) (RI01665720)

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 IDRI01665720
Compound Identification
Common NamePS(18:3(6Z,9Z,12Z)/20:5(5Z,8Z,10E,14Z,17Z)-OH(12))
Structure
Average Molecular Weight819.4686
SMILES[H][C@@](COC(=O)CCCC\C=C/C\C=C/C\C=C/CCCCC)(COP(O)(=O)OC[C@H](N)C(O)=O)OC(=O)CCC\C=C/C\C=C/C=C/C(O)C\C=C/C\C=C/CC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4849.5
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices