Showing RIpred-Card for PS(18:1(11Z)/20:5(6E,8Z,11Z,14Z,17Z)-OH(5)) (RI01664808)

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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 IDRI01664808
Compound Identification
Common NamePS(18:1(11Z)/20:5(6E,8Z,11Z,14Z,17Z)-OH(5))
Structure
Average Molecular Weight823.4999
SMILES[H][C@@](COC(=O)CCCCCCCCC\C=C/CCCCCC)(COP(O)(=O)OC[C@H](N)C(O)=O)OC(=O)CCCC(O)\C=C\C=C/C\C=C/C\C=C/C\C=C/CC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5035.7417
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices