Showing RIpred-Card for PGP(20:4(5E,8Z,12Z,14Z)-OH(11R)/i-12:0) (RI01659164)

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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 IDRI01659164
Compound Identification
Common NamePGP(20:4(5E,8Z,12Z,14Z)-OH(11R)/i-12:0)
Structure
Average Molecular Weight810.4084
SMILES[H][C@](O)(COP(O)(O)=O)COP(O)(=O)OC[C@@]([H])(COC(=O)CCC\C=C\C\C=C/C[C@H](O)\C=C/C=C\CCCCC)OC(=O)CCCCCCCCC(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5607.063
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices