Showing RIpred-Card for Leukotriene C4,3TMS,isomer#25 (RI00065486)

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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 IDRI00065486
Compound Identification
Common NameLeukotriene C4,3TMS,isomer#25
Structure
Average Molecular Weight841.4219
SMILESCCCCC/C=C\C/C=C\C=C\C=C\[C@@H](SC[C@H](NC(=O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)NCC(=O)O[Si](C)(C)C)[C@@H](O)CCCC(=O)O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5366.049
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices