Chem
J-GLOBAL ID：200907074695755582   Nikkaji number：J2.089.190D

N-Benzoyl-9-[2-O-(tert-butyldimethylsilyl)-5-O-(4,4′-dimethoxytrityl)-4-thio-β-D-ribo-pentofuranosyl]-9H-purine-6-amine

N-ベンゾイル-9-[2-O-(tert-ブチルジメチルシリル)-5-O-(4,4′-ジメトキシトリチル)-4-チオ-β-D-ribo-ペントフラノシル]-9H-プリン-6-アミン
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： C44H49N5O6SSi
Molecular formula furigana： C44-H49-N5-O6-S-SI
Molecular weight： 804.050
InChI： InChI=1S/C44H49N5O6SSi/c1-43(2,3)57(6,7)55-38-37(50)35(56-42(38)49-28-47-36-39(45-27-46-40(36)49)48-41(51)29-14-10-8-11-15-29)26-54-44(30-16-12-9-13-17-30,31-18-22-33(52-4)23-19-31)32-20-24-34(53-5)25-21-32/h8-25,27-28,35,37-38,42,50H,26H2,1-7H3,(H,45,46,48,51)/t35-,37-,38-,42-/m1/s1
InChI key： GWXGAKIIXTXABT-GNECSJIWSA-N
SMILES： COc1ccc(cc1)C(OC[C@H]1S[C@H]([C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O)n1cnc2c(NC(=O)c3ccccc3)ncnc12)(c1ccccc1)c1ccc(OC)cc1
Systematic name  (3)：
  • N-ベンゾイル-9-[2-O-(tert-ブチルジメチルシリル)-5-O-(4,4′-ジメトキシトリチル)-4-チオ-β-D-ribo-ペントフラノシル]-9H-プリン-6-アミン
  • N-{9-[(2R,3R,4S,5R)-5-{[ビス(4-メトキシフェニル)(フェニル)メトキシ]メチル}-3-[(tert-ブチルジメチルシリル)オキシ]-4-ヒドロキシチオラン-2-イル]-9H-プリン-6-イル}ベンズアミド
  • N-{9-[(2R,3R,4S,5R)-5-{[bis(4-methoxyphenyl)(phenyl)methoxy]methyl}-3-[(tert-butyldimethylsilyl)oxy]-4-hydroxythiolan-2-yl]-9H-purin-6-yl}benzamide
Other name (1)：
  • N-Benzoyl-9-[2-O-(tert-butyldimethylsilyl)-5-O-(4,4′-dimethoxytrityl)-4-thio-β-D-ribo-pentofuranosyl]-9H-purine-6-amine
Thsaurus map：
Thesaurus Map

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