Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01706398
Compound Identification
Common Name2,5-diamino-6-(5-phospho-D-ribitylamino)pyrimidin-4(3H)-one,4TBDMS,isomer#136
Structure
Average Molecular Weight811.4352
SMILESCC(C)(C)[Si](C)(C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)O)C1=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)N([Si](C)(C)C(C)(C)C)C(N)=N1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5478.9355
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices