Showing RIpred-Card for PGP(16:1(9Z)/20:3(5Z,8Z,14Z)-O(11S,12R)) (RI01656597)

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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 IDRI01656597
Compound Identification
Common NamePGP(16:1(9Z)/20:3(5Z,8Z,14Z)-O(11S,12R))
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/CC1OC1C\C=C/CCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4692.6523
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices