Showing RIpred-Card for PS(16:0/20:4(6E,8Z,11Z,13E)-2OH(5S,15S)) (RI01663909)

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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 IDRI01663909
Compound Identification
Common NamePS(16:0/20:4(6E,8Z,11Z,13E)-2OH(5S,15S))
Structure
Average Molecular Weight815.4949
SMILES[H][C@@](COC(=O)CCCCCCCCCCCCCCC)(COP(O)(=O)OC[C@H](N)C(O)=O)OC(=O)CCC[C@H](O)\C=C\C=C/C\C=C/C=C/[C@H](O)CCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5989.836
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices