Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01664549
Compound Identification
Common NamePS(18:0/22:6(4Z,7Z,10Z,13E,15E,19Z)-OH(17))
Structure
Average Molecular Weight851.5312
SMILES[H][C@@](COC(=O)CCCCCCCCCCCCCCCCC)(COP(O)(=O)OC[C@H](N)C(O)=O)OC(=O)CC\C=C/C\C=C/C\C=C/C\C=C\C=C\C(O)C\C=C/CC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index6202.0674
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices