Showing RIpred-Card for PS(20:0/20:4(6E,8Z,11Z,14Z)-OH(5S)) (RI01666468)

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 IDRI01666468
Compound Identification
Common NamePS(20:0/20:4(6E,8Z,11Z,14Z)-OH(5S))
Structure
Average Molecular Weight855.5625
SMILES[H][C@@](COC(=O)CCCCCCCCCCCCCCCCCCC)(COP(O)(=O)OC[C@H](N)C(O)=O)OC(=O)CCC[C@@H](O)\C=C\C=C/C\C=C/C\C=C/CCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index6176.406
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices