Metabolomics Structure Database

 
MW REGNO: 87101
Common Name:5,6-Dihydrothymidine
Systematic Name:1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-hexahydropyrimidine-2,4-dione
RefMet Name:5,6-Dihydrothymidine
Synonyms:Dihydrothymidine [PubChem Synonyms]
Exact Mass:
244.1059 (neutral)    Calculate m/z:
Formula:C10H16N2O5
InChIKey:FEYHMSUYKIMUAL-UNYLCCJPSA-N
ClassyFire superclass:Nucleosides, nucleotides, and analogues [C0000289]
ClassyFire class:Pyrimidine nucleosides [C0000480]
ClassyFire subclass:Pyrimidine 2'-deoxyribonucleosides [C0002180]
ClassyFire direct parent:Pyrimidine 2'-deoxyribonucleosides [C0002180]
Massbank MS spectra:View MS spectra
SMILES:CC1CN([C@H]2C[C@@H]([C@@H](CO)O2)O)C(=O)NC1=O
Studies:Available studies (via RefMet name)

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External database links:

PubChem CID:165328
CHEBI ID:132171
Chemspider ID:144932

References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y

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