Showing RIpred-Card for PGP(16:1(9Z)/20:4(5E,8Z,12Z,14Z)-OH(11R)) (RI01656664)

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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 IDRI01656664
Compound Identification
Common NamePGP(16:1(9Z)/20:4(5E,8Z,12Z,14Z)-OH(11R))
Structure
Average Molecular Weight864.4554
SMILES[H][C@](O)(COP(O)(O)=O)COP(O)(=O)OC[C@@]([H])(COC(=O)CCCCCCC\C=C/CCCCCC)OC(=O)CCC\C=C\C\C=C/C[C@@H](O)\C=C/C=C\CCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index6098.8574
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices