Chem
J-GLOBAL ID：200907013602879270   Nikkaji number：J569.875H

5-[(Pentafluorophenyl)ethynyl]-2′-deoxyuridine

5-[(ペンタフルオロフェニル)エチニル]-2′-デオキシウリジン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C17H11F5N2O5
Molecular formula furigana： C17-H11-F5-N2-O5
Molecular weight： 418.276
InChI： InChI=1S/C17H11F5N2O5/c18-11-7(12(19)14(21)15(22)13(11)20)2-1-6-4-24(17(28)23-16(6)27)10-3-8(26)9(5-25)29-10/h4,8-10,25-26H,3,5H2,(H,23,27,28)/t8-,9+,10+/m0/s1
InChI key： SAMABCWQYTYQMG-IVZWLZJFSA-N
SMILES： OC[C@H]1O[C@H](C[C@@H]1O)n1cc(C#Cc2c(F)c(F)c(F)c(F)c2F)c(=O)[nH]c1=O
Systematic name  (3)：
  • 5-[(ペンタフルオロフェニル)エチニル]-2′-デオキシウリジン
  • 1-[(2R,4S,5R)-4-ヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]-5-[2-(2,3,4,5,6-ペンタフルオロフェニル)エチニル]-1,2,3,4-テトラヒドロピリミジン-2,4-ジオン
  • 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-[2-(2,3,4,5,6-pentafluorophenyl)ethynyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1)：
  • 5-[(Pentafluorophenyl)ethynyl]-2′-deoxyuridine
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