Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01706107
Compound Identification
Common Name2,5-diamino-6-(5-phospho-D-ribitylamino)pyrimidin-4(3H)-one,6TMS,isomer#160
Structure
Average Molecular Weight787.3265
SMILESC[Si](C)(C)NC1=NC(NC[C@H](O)[C@H](O)[C@@H](COP(=O)(O)O[Si](C)(C)C)O[Si](C)(C)C)=C(N([Si](C)(C)C)[Si](C)(C)C)C(=O)N1[Si](C)(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4543.8584
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices