Chem
J-GLOBAL ID:200907096590629127   Nikkaji number:J2.346.661I

3′-O-(tert-Butyldimethylsilyl)-4′-(2-nitrobenzyloxy)thymidine

3′-O-(tert-ブチルジメチルシリル)-4′-(2-ニトロベンジルオキシ)チミジン
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: C23H33N2[N+]O7[O-]Si
Molecular formula furigana: C23-H33-N3-O8-SI
Molecular weight: 507.615
InChI: InChI=1S/C23H33N3O8Si/c1-15-12-25(21(29)24-20(15)28)19-11-18(34-35(5,6)22(2,3)4)23(14-27,33-19)32-13-16-9-7-8-10-17(16)26(30)31/h7-10,12,18-19,27H,11,13-14H2,1-6H3,(H,24,28,29)/t18-,19+,23+/m0/s1
InChI key: BAXLWGPUYGWHRD-YCRNBWNJSA-N
SMILES: Cc1cn([C@H]2C[C@H](O[Si](C)(C)C(C)(C)C)[C@](CO)(OCc3ccccc3[N+](=O)[O-])O2)c(=O)[nH]c1=O
Systematic name  (3):
  • 3′-O-(tert-ブチルジメチルシリル)-4′-(2-ニトロベンジルオキシ)チミジン
  • 1-[(2R,4S,5R)-4-[(tert-ブチルジメチルシリル)オキシ]-5-(ヒドロキシメチル)-5-[(2-ニトロフェニル)メトキシ]オキソラン-2-イル]-5-メチル-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-[(tert-butyldimethylsilyl)oxy]-5-(hydroxymethyl)-5-[(2-nitrophenyl)methoxy]oxolan-2-yl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1):
  • 3′-O-(tert-Butyldimethylsilyl)-4′-(2-nitrobenzyloxy)thymidine
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