Chem
J-GLOBAL ID：200907003293904013   Nikkaji number：J2.089.180G

1-[2-O-(tert-Butyldimethylsilyl)-3-O-(3-carboxypropanoyl)-5-O-(4,4′-dimethoxytrityl)-4-thio-β-D-ribo-pentofuranosyl]uracil

1-[2-O-(tert-ブチルジメチルシリル)-3-O-(3-カルボキシプロパノイル)-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]ウラシル
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： C40H48N2O10SSi
Molecular formula furigana： C40-H48-N2-O10-S-SI
Molecular weight： 776.970
InChI： InChI=1S/C40H48N2O10SSi/c1-39(2,3)54(6,7)52-36-35(51-34(46)22-21-33(44)45)31(53-37(36)42-24-23-32(43)41-38(42)47)25-50-40(26-11-9-8-10-12-26,27-13-17-29(48-4)18-14-27)28-15-19-30(49-5)20-16-28/h8-20,23-24,31,35-37H,21-22,25H2,1-7H3,(H,44,45)(H,41,43,47)/t31-,35-,36-,37-/m1/s1
InChI key： HZWQHBSDYFKIRK-MCNAWRSPSA-N
SMILES： COc1ccc(cc1)C(OC[C@H]1S[C@H]([C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1OC(=O)CCC(=O)O)n1ccc(=O)[nH]c1=O)(c1ccccc1)c1ccc(OC)cc1
Systematic name  (3)：
  • 1-[2-O-(tert-ブチルジメチルシリル)-3-O-(3-カルボキシプロパノイル)-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]ウラシル
  • 4-{[(2R,3S,4R,5R)-2-{[ビス(4-メトキシフェニル)(フェニル)メトキシ]メチル}-4-[(tert-ブチルジメチルシリル)オキシ]-5-(2,4-ジオキソ-1,2,3,4-テトラヒドロピリミジン-1-イル)チオラン-3-イル]オキシ}-4-オキソブタン酸
  • 4-{[(2R,3S,4R,5R)-2-{[bis(4-methoxyphenyl)(phenyl)methoxy]methyl}-4-[(tert-butyldimethylsilyl)oxy]-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)thiolan-3-yl]oxy}-4-oxobutanoic acid
Other name (1)：
  • 1-[2-O-(tert-Butyldimethylsilyl)-3-O-(3-carboxypropanoyl)-5-O-(4,4′-dimethoxytrityl)-4-thio-β-D-ribo-pentofuranosyl]uracil
Thsaurus map：
Thesaurus Map

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