Showing RIpred-Card for PS(20:4(5Z,8Z,10E,14Z)-OH(12S)/15:0) (RI01663449)

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 IDRI01663449
Compound Identification
Common NamePS(20:4(5Z,8Z,10E,14Z)-OH(12S)/15:0)
Structure
Average Molecular Weight785.4843
SMILES[H][C@@](COC(=O)CCC\C=C/C\C=C/C=C/[C@H](O)C\C=C/CCCCC)(COP(O)(=O)OC[C@H](N)C(O)=O)OC(=O)CCCCCCCCCCCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4868.5293
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices