Showing RIpred-Card for PGP(20:4(5Z,8Z,10E,14Z)-OH(12S)/a-15:0) (RI01658663)

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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 IDRI01658663
Compound Identification
Common NamePGP(20:4(5Z,8Z,10E,14Z)-OH(12S)/a-15:0)
Structure
Average Molecular Weight852.4554
SMILES[H][C@](O)(COP(O)(O)=O)COP(O)(=O)OC[C@@]([H])(COC(=O)CCC\C=C/C\C=C/C=C/[C@H](O)C\C=C/CCCCC)OC(=O)CCCCCCCCCCC(C)CC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5749.6387
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices