Showing RIpred-Card for Cytidine 5'-monophosphate-N-acetylneuraminic acid,2TBDMS,isomer#40 (RI00063097)

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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 IDRI00063097
Compound Identification
Common NameCytidine 5'-monophosphate-N-acetylneuraminic acid,2TBDMS,isomer#40
Structure
Average Molecular Weight842.3202
SMILESCC(=O)N[C@@H]1[C@@H](O)C[C@@](OP(=O)(OC[C@H]2O[C@@H](N3C=CC(N)=NC3=O)[C@H](O)[C@@H]2O)O[Si](C)(C)C(C)(C)C)(C(=O)O)O[C@H]1[C@H](O)[C@H](O)CO[Si](C)(C)C(C)(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5002.5474
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices