Showing RIpred-Card for PGP(a-13:0/22:5(4Z,7Z,10Z,13Z,19Z)-O(16,17)) (RI01658552)

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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 IDRI01658552
Compound Identification
Common NamePGP(a-13:0/22:5(4Z,7Z,10Z,13Z,19Z)-O(16,17))
Structure
Average Molecular Weight848.4241
SMILES[H][C@](O)(COP(O)(O)=O)COP(O)(=O)OC[C@@]([H])(COC(=O)CCCCCCCCC(C)CC)OC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/CC1OC1C\C=C/CC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5712.3145
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices