Chem
J-GLOBAL ID：200907079410710744   Nikkaji number：J1.969.618I

6-(Benzoylamino)-9-[(2S,4S,5S)-4-[(diethoxythiophophinyl)difluoromethyl]-5-(tert-butyldiphenylsilyloxymethyl)tetrahydrofuran-2-yl]-9H-purine

6-(ベンゾイルアミノ)-9-[(2S,4S,5S)-4-[(ジエトキシチオホスフィニル)ジフルオロメチル]-5-(tert-ブチルジフェニルシリルオキシメチル)テトラヒドロフラン-2-イル]-9H-プリン
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： C38H44F2N5O5PSSi
Molecular formula furigana： C38-H44-F2-N5-O5-P-S-SI
Molecular weight： 779.920
InChI： InChI=1S/C38H44F2N5O5PSSi/c1-6-47-51(52,48-7-2)38(39,40)30-23-32(45-26-43-33-34(41-25-42-35(33)45)44-36(46)27-17-11-8-12-18-27)50-31(30)24-49-53(37(3,4)5,28-19-13-9-14-20-28)29-21-15-10-16-22-29/h8-22,25-26,30-32H,6-7,23-24H2,1-5H3,(H,41,42,44,46)/t30-,31+,32-/m0/s1
InChI key： WGLHLMDBAUIPEZ-QAXCHELISA-N
SMILES： CCOP(=S)(OCC)C(F)(F)[C@H]1C[C@H](O[C@@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)n1cnc2c(NC(=O)c3ccccc3)ncnc12
Systematic name  (3)：
  • 6-(ベンゾイルアミノ)-9-[(2S,4S,5S)-4-[(ジエトキシチオホスフィニル)ジフルオロメチル]-5-(tert-ブチルジフェニルシリルオキシメチル)テトラヒドロフラン-2-イル]-9H-プリン
  • O,O-ジエチル {[(2S,3S,5S)-5-(6-ベンズアミド-9H-プリン-9-イル)-2-{[(tert-ブチルジフェニルシリル)オキシ]メチル}オキソラン-3-イル]ジフルオロメチル}ホスホノチオアート
  • O,O-diethyl {[(2S,3S,5S)-5-(6-benzamido-9H-purin-9-yl)-2-{[(tert-butyldiphenylsilyl)oxy]methyl}oxolan-3-yl]difluoromethyl}phosphonothioate
Other name (1)：
  • 6-(Benzoylamino)-9-[(2S,4S,5S)-4-[(diethoxythiophophinyl)difluoromethyl]-5-(tert-butyldiphenylsilyloxymethyl)tetrahydrofuran-2-yl]-9H-purine
Thsaurus map：
Thesaurus Map

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