Showing RIpred-Card for PS(20:5(5Z,8Z,11Z,14Z,16E)-OH(18R)/18:3(6Z,9Z,12Z)) (RI01665710)

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IdentificationPhysical propertiesReferencesXML
Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01665710
Compound Identification
Common NamePS(20:5(5Z,8Z,11Z,14Z,16E)-OH(18R)/18:3(6Z,9Z,12Z))
Structure
Average Molecular Weight819.4686
SMILES[H][C@@](COC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/C=C/[C@@H](O)CC)(COP(O)(=O)OC[C@H](N)C(O)=O)OC(=O)CCCC\C=C/C\C=C/C\C=C/CCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index6594.4766
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices