Chem
J-GLOBAL ID：200907084057503105   Nikkaji number：J1.754.239G

2′-O,3′-O-Dibenzoyl-5′-O-[[2-(trimethylsilyl)ethoxy](diisopropylamino)phosphono]-7,8-dihydro-8-oxo-N-acetyladenosine

2′-O,3′-O-ジベンゾイル-5′-O-[[2-(トリメチルシリル)エトキシ](ジイソプロピルアミノ)ホスホノ]-7,8-ジヒドロ-8-オキソ-N-アセチルアデノシン
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： C37H49N6O12PSi
Molecular formula furigana： C37-H49-N6-O12-P-SI
Molecular weight： 828.888
InChI： InChI=1S/C37H49N6O12PSi/c1-23(2)43(24(3)4)54-56(48,55-49-19-20-57(6,7)8)50-21-28-30(52-35(45)26-15-11-9-12-16-26)31(53-36(46)27-17-13-10-14-18-27)34(51-28)42-33-29(41-37(42)47)32(38-22-39-33)40-25(5)44/h9-18,22-24,28,30-31,34H,19-21H2,1-8H3,(H,41,47)(H,38,39,40,44)/t28-,30-,31-,34-,56?/m1/s1
InChI key： CAHBEFGDYSXXDY-JNPKTDEPSA-N
SMILES： CC(C)N(OP(=O)(OC[C@H]1O[C@H]([C@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)n1c2ncnc(NC(=O)C)c2[nH]c1=O)OOCC[Si](C)(C)C)C(C)C
Systematic name  (3)：
  • 2′-O,3′-O-ジベンゾイル-5′-O-[[2-(トリメチルシリル)エトキシ](ジイソプロピルアミノ)ホスホノ]-7,8-ジヒドロ-8-オキソ-N-アセチルアデノシン
  • (2R,3R,4R,5R)-4-(ベンゾイルオキシ)-5-{[({[ビス(プロパン-2-イル)アミノ]オキシ}({[2-(トリメチルシリル)エチル]ペルオキシ})ホスホリル)オキシ]メチル}-2-(6-アセトアミド-8-オキソ-8,9-ジヒドロ-7H-プリン-9-イル)オキソラン-3-イル ベンゾアート
  • (2R,3R,4R,5R)-4-(benzoyloxy)-5-{[({[bis(propan-2-yl)amino]oxy}({[2-(trimethylsilyl)ethyl]peroxy})phosphoryl)oxy]methyl}-2-(6-acetamido-8-oxo-8,9-dihydro-7H-purin-9-yl)oxolan-3-yl benzoate
Other name (1)：
  • 2′-O,3′-O-Dibenzoyl-5′-O-[[2-(trimethylsilyl)ethoxy](diisopropylamino)phosphono]-7,8-dihydro-8-oxo-N-acetyladenosine
Thsaurus map：
Thesaurus Map

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