Chem
J-GLOBAL ID：200907001728930272   Nikkaji number：J2.055.905E

Adenosine-5′-[[[[[(3R)-1-[3-(aminocarbonyl)benzyl]-4β-hydroxypyrrolidine-3α-yl]methoxy]phosphonyl]methyl]phosphonic acid]

アデノシン-5′-[[[[[(3R)-1-[3-(アミノカルボニル)ベンジル]-4β-ヒドロキシピロリジン-3α-イル]メトキシ]ホスホニル]メチル]ホスホン酸]
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： C24H33N7O11P2
Molecular formula furigana： C24-H33-N7-O11-P2
Molecular weight： 657.514
InChI： InChI=1S/C24H33N7O11P2/c25-21-18-23(28-10-27-21)31(11-29-18)24-20(34)19(33)17(42-24)9-41-44(38,39)12-43(36,37)40-8-15-6-30(7-16(15)32)5-13-2-1-3-14(4-13)22(26)35/h1-4,10-11,15-17,19-20,24,32-34H,5-9,12H2,(H2,26,35)(H,36,37)(H,38,39)(H2,25,27,28)/t15-,16+,17-,19-,20-,24-/m1/s1
InChI key： IMHBNZNABRBOGP-YZOALNMRSA-N
SMILES： NC(=O)c1cccc(CN2C[C@H](O)[C@@H](COP(=O)(O)CP(=O)(O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)C2)c1
Systematic name  (3)：
  • アデノシン-5′-[[[[[(3R)-1-[3-(アミノカルボニル)ベンジル]-4β-ヒドロキシピロリジン-3α-イル]メトキシ]ホスホニル]メチル]ホスホン酸]
  • {[(2R,3S,4R,5R)-5-(6-アミノ-9H-プリン-9-イル)-3,4-ジヒドロキシオキソラン-2-イル]メトキシ}[({[(3R,4R)-1-[(3-カルバモイルフェニル)メチル]-4-ヒドロキシピロリジン-3-イル]メトキシ}(ヒドロキシ)ホスホリル)メチル]ホスフィン酸
  • {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}[({[(3R,4R)-1-[(3-carbamoylphenyl)methyl]-4-hydroxypyrrolidin-3-yl]methoxy}(hydroxy)phosphoryl)methyl]phosphinic acid
Other name (1)：
  • Adenosine-5′-[[[[[(3R)-1-[3-(aminocarbonyl)benzyl]-4β-hydroxypyrrolidine-3α-yl]methoxy]phosphonyl]methyl]phosphonic acid]
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