Showing RIpred-Card for Sarecycline,5TMS,isomer#4 (RI01722647)

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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 IDRI01722647
Compound Identification
Common NameSarecycline,5TMS,isomer#4
Structure
Average Molecular Weight847.3931
SMILESCON(C)CC1=CC=C(O)C2=C1C[C@H]1C[C@H]3[C@H](N(C)C)C(O[Si](C)(C)C)=C(C(=O)N([Si](C)(C)C)[Si](C)(C)C)C(=O)[C@@]3(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1C2=O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4161.8735
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices