Showing RIpred-Card for Quadrangularin A,4TMS,isomer#88 (RI01716486)

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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 IDRI01716486
Compound Identification
Common NameQuadrangularin A,4TMS,isomer#88
Structure
Average Molecular Weight866.3005
SMILESC[Si](C)(C)OC1=CC(O)=CC2=C1[C@H](C1=C(O[Si](C)(C)C)C=C3O[C@H](C4=CC=C(O)C(O)=C4)[C@@H](O)CC3=C1O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](C1=CC=C(O)C(O)=C1)O2
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index6444.128
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices