Chem
J-GLOBAL ID：200907001602228076   Nikkaji number：J1.302.849D

5′-[[5′-[[5′-[[5′-Amino-2′-O-(tert-butyldimethylsilyl)-3′,5′-dideoxyuridine-3′-yl]acetylamino]-2′-O-(tert-butyldimethylsilyl)-3′,5′-dideoxyuridine-3′-yl]acetylamino]-2′-O-(tert-butyldimethylsilyl)-3′,5′-dideoxyuridine-3′-yl]acetylamino]-2′-O,3′-O-bis(tert-butyldimethylsilyl)-5′-deoxyuridine

5′-[[5′-[[5′-[[5′-アミノ-2′-O-(tert-ブチルジメチルシリル)-3′,5′-ジデオキシウリジン-3′-イル]アセチルアミノ]-2′-O-(tert-ブチルジメチルシリル)-3′,5′-ジデオキシウリジン-3′-イル]アセチルアミノ]-2′-O-(tert-ブチルジメチルシリル)-3′,5′-ジデオキシウリジン-3′-イル]アセチルアミノ]-2′-O,3′-O-ビス(tert-ブチルジメチルシリル)-5′-デオキシウリジン
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： C72H122N12O20Si5
Molecular formula furigana： C72-H122-N12-O20-SI5
Molecular weight： 1616.257
InChI： InChI=1S/C72H122N12O20Si5/c1-68(2,3)105(16,17)100-55-41(44(37-73)96-60(55)81-30-26-48(85)77-64(81)92)34-52(89)74-38-45-42(56(101-106(18,19)69(4,5)6)61(97-45)82-31-27-49(86)78-65(82)93)35-53(90)75-39-46-43(57(102-107(20,21)70(7,8)9)62(98-46)83-32-28-50(87)79-66(83)94)36-54(91)76-40-47-58(103-108(22,23)71(10,11)12)59(104-109(24,25)72(13,14)15)63(99-47)84-33-29-51(88)80-67(84)95/h26-33,41-47,55-63H,34-40,73H2,1-25H3,(H,74,89)(H,75,90)(H,76,91)(H,77,85,92)(H,78,86,93)(H,79,87,94)(H,80,88,95)/t41-,42-,43-,44-,45-,46-,47-,55-,56-,57-,58-,59-,60-,61-,62-,63-/m1/s1
InChI key： AKDOJJYLONSDRS-ZYHJDQTQSA-N
SMILES： CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](CNC(=O)C[C@@H]2[C@@H](CNC(=O)C[C@@H]3[C@@H](CNC(=O)C[C@@H]4[C@@H](CN)O[C@H]([C@@H]4O[Si](C)(C)C(C)(C)C)n4ccc(=O)[nH]c4=O)O[C@H]([C@@H]3O[Si](C)(C)C(C)(C)C)n3ccc(=O)[nH]c3=O)O[C@H]([C@@H]2O[Si](C)(C)C(C)(C)C)n2ccc(=O)[nH]c2=O)O[C@H]([C@@H]1O[Si](C)(C)C(C)(C)C)n1ccc(=O)[nH]c1=O
Systematic name  (3)：
  • 5′-[[5′-[[5′-[[5′-アミノ-2′-O-(tert-ブチルジメチルシリル)-3′,5′-ジデオキシウリジン-3′-イル]アセチルアミノ]-2′-O-(tert-ブチルジメチルシリル)-3′,5′-ジデオキシウリジン-3′-イル]アセチルアミノ]-2′-O-(tert-ブチルジメチルシリル)-3′,5′-ジデオキシウリジン-3′-イル]アセチルアミノ]-2′-O,3′-O-ビス(tert-ブチルジメチルシリル)-5′-デオキシウリジン
  • 2-[(2S,3R,4R,5R)-2-({2-[(2S,3R,4R,5R)-2-({2-[(2S,3R,4R,5R)-2-(アミノメチル)-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)オキソラン-3-イル]アセトアミド}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)オキソラン-3-イル]アセトアミド}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)オキソラン-3-イル]-N-{[(2R,3R,4R,5R)-3,4-ビス[(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)オキソラン-2-イル]メチル}アセトアミド
  • 2-[(2S,3R,4R,5R)-2-({2-[(2S,3R,4R,5R)-2-({2-[(2S,3R,4R,5R)-2-(aminomethyl)-4-[(tert-butyldimethylsilyl)oxy]-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-3-yl]acetamido}methyl)-4-[(tert-butyldimethylsilyl)oxy]-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-3-yl]acetamido}methyl)-4-[(tert-butyldimethylsilyl)oxy]-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-3-yl]-N-{[(2R,3R,4R,5R)-3,4-bis[(tert-butyldimethylsilyl)oxy]-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methyl}acetamide
Other name (1)：
  • 5′-[[5′-[[5′-[[5′-Amino-2′-O-(tert-butyldimethylsilyl)-3′,5′-dideoxyuridine-3′-yl]acetylamino]-2′-O-(tert-butyldimethylsilyl)-3′,5′-dideoxyuridine-3′-yl]acetylamino]-2′-O-(tert-butyldimethylsilyl)-3′,5′-dideoxyuridine-3′-yl]acetylamino]-2′-O,3′-O-bis(tert-butyldimethylsilyl)-5′-deoxyuridine
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