Metabolomics Structure Database
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MW REGNO: | 145173 |
Common Name: | Trifluridine |
Systematic Name: | 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(trifluoromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione |
Synonyms: | 5-(Trifluoromethyl)deoxyuridine; 5-Trifluoromethyl-2-deoxyuridine; F?T; TFT; Trifluoromethyldeoxyuridine; Trifluorothymidine; Trifluorothymine deoxyriboside; Trifluridin; Trifluridina; Trifluridine; Trifluridinum [PubChem Synonyms] |
Exact Mass: | |
Formula: | C10H11F3N2O5 |
InChIKey: | VSQQQLOSPVPRAZ-RRKCRQDMSA-N |
ClassyFire superclass: | Nucleosides, nucleotides, and analogues [C0000289] |
ClassyFire class: | Pyrimidine nucleosides [C0000480] |
ClassyFire subclass: | Pyrimidine 2'-deoxyribonucleosides [C0002180] |
SMILES: | O[C@@H]1C[C@H](O[C@H]1CO)N1C=C(C(=O)NC1=O)C(F)(F)F |
Studies: | - |
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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