Showing RIpred-Card for PG(20:4(7E,9E,11Z,13E)-3OH(5S,6R,15S)/i-21:0) (RI01655770)

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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 IDRI01655770
Compound Identification
Common NamePG(20:4(7E,9E,11Z,13E)-3OH(5S,6R,15S)/i-21:0)
Structure
Average Molecular Weight888.5728
SMILES[H][C@](O)(CO)COP(O)(=O)OC[C@@]([H])(COC(=O)CCC[C@@H](O)[C@H](O)\C=C\C=C\C=C/C=C/[C@H](O)CCCCC)OC(=O)CCCCCCCCCCCCCCCCCC(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index6456.2446
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices