Chem
J-GLOBAL ID：200907013080409260   Nikkaji number：J1.924.965D

1-[2-(4-Methoxytritylamino)-6-(benzyloxy)-8-bromo-9H-purine-9-yl]-1,2-dideoxy-β-D-erythro-pentofuranose 3,5-diacetate

1-[2-(4-メトキシトリチルアミノ)-6-(ベンジルオキシ)-8-ブロモ-9H-プリン-9-イル]-1,2-ジデオキシ-β-D-erythro-ペントフラノース3,5-ジアセタート
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： C41H38BrN5O7
Molecular formula furigana： C41-H38-BR-N5-O7
Molecular weight： 792.687
InChI： InChI=1S/C41H38BrN5O7/c1-26(48)51-25-34-33(53-27(2)49)23-35(54-34)47-37-36(43-39(47)42)38(52-24-28-13-7-4-8-14-28)45-40(44-37)46-41(29-15-9-5-10-16-29,30-17-11-6-12-18-30)31-19-21-32(50-3)22-20-31/h4-22,33-35H,23-25H2,1-3H3,(H,44,45,46)/t33-,34+,35+/m0/s1
InChI key： KCMYBDBQEFONTJ-BMPTZRATSA-N
SMILES： COc1ccc(cc1)C(Nc1nc(OCc2ccccc2)c2nc(Br)n([C@H]3C[C@H](OC(=O)C)[C@@H](COC(=O)C)O3)c2n1)(c1ccccc1)c1ccccc1
Systematic name  (3)：
  • 1-[2-(4-メトキシトリチルアミノ)-6-(ベンジルオキシ)-8-ブロモ-9H-プリン-9-イル]-1,2-ジデオキシ-β-D-erythro-ペントフラノース3,5-ジアセタート
  • [(2R,3S,5R)-3-(アセチルオキシ)-5-[6-(ベンジルオキシ)-8-ブロモ-2-{[(4-メトキシフェニル)ジフェニルメチル]アミノ}-9H-プリン-9-イル]オキソラン-2-イル]メチル アセタート
  • [(2R,3S,5R)-3-(acetyloxy)-5-[6-(benzyloxy)-8-bromo-2-{[(4-methoxyphenyl)diphenylmethyl]amino}-9H-purin-9-yl]oxolan-2-yl]methyl acetate
Other name (1)：
  • 1-[2-(4-Methoxytritylamino)-6-(benzyloxy)-8-bromo-9H-purine-9-yl]-1,2-dideoxy-β-D-erythro-pentofuranose 3,5-diacetate
Thsaurus map：
Thesaurus Map

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