Showing RIpred-Card for secologanin,5TMS,isomer#1 (RI01714438)

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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 IDRI01714438
Compound Identification
Common Namesecologanin,5TMS,isomer#1
Structure
Average Molecular Weight748.3346
SMILESC=C[C@H]1[C@H](O[C@@H]2O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)OC=C(C(=O)OC)[C@H]1C=CO[Si](C)(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3437.0945
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices