Showing RIpred-Card for PI(20:3(5Z,8Z,11Z)-O(14R,15S)/16:2(9Z,12Z)) (RI01661459)

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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 IDRI01661459
Compound Identification
Common NamePI(20:3(5Z,8Z,11Z)-O(14R,15S)/16:2(9Z,12Z))
Structure
Average Molecular Weight870.4894
SMILES[H][C@@](COC(=O)CCC\C=C/C\C=C/C\C=C/CC1OC1CCCCC)(COP(O)(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O)OC(=O)CCCCCCC\C=C/C\C=C/CCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5224.7974
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices