Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01659358
Compound Identification
Common NamePGP(22:5(4Z,7Z,10Z,13Z,19Z)-O(16,17)/i-12:0)
Structure
Average Molecular Weight834.4084
SMILES[H][C@](O)(COP(O)(O)=O)COP(O)(=O)OC[C@@]([H])(COC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/CC1OC1C\C=C/CC)OC(=O)CCCCCCCCC(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5566.5376
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices