Showing RIpred-Card for PGP(20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15)/16:1(9Z)) (RI01656792)

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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 IDRI01656792
Compound Identification
Common NamePGP(20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15)/16:1(9Z))
Structure
Average Molecular Weight894.4296
SMILES[H][C@](O)(COP(O)(O)=O)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)C\C=C/CC)OC(=O)CCCCCCC\C=C/CCCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4690.975
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices