Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01658529
Compound Identification
Common NamePGP(a-13:0/22:6(4Z,8Z,10Z,13Z,16Z,19Z)-OH(7))
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/CC(O)\C=C/C=C\C\C=C/C\C=C/C\C=C/CC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4507.6475
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices