Chem
J-GLOBAL ID：200907045769149396   Nikkaji number：J1.664.477C

2′-O-(Oxylatophosphonyl)-3′-O-[3-O,4-O-bis(oxylatophosphonyl)-α-D-glucopyranosyl]adenosine

2′-O-(オキシラトホスホニル)-3′-O-[3-O,4-O-ビス(オキシラトホスホニル)-α-D-グルコピラノシル]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： C16H23N5O15[O-]3P3
Molecular formula furigana： C16-H23-N5-O18-P3
Molecular weight： 666.300
InChI： InChI=1S/C16H26N5O18P3/c17-13-7-14(19-3-18-13)21(4-20-7)15-12(39-42(31,32)33)9(5(1-22)34-15)36-16-8(24)11(38-41(28,29)30)10(6(2-23)35-16)37-40(25,26)27/h3-6,8-12,15-16,22-24H,1-2H2,(H2,17,18,19)(H2,25,26,27)(H2,28,29,30)(H2,31,32,33)/p-3/t5-,6-,8-,9-,10-,11-,12-,15-,16-/m1/s1
InChI key： RENVITLQVBEFDT-MZQFDOALSA-K
SMILES： Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](OP(=O)(O)[O-])[C@H](OP(=O)(O)[O-])[C@H]2O)[C@H]1OP(=O)(O)[O-]
Systematic name  (3)：
  • 2′-O-(オキシラトホスホニル)-3′-O-[3-O,4-O-ビス(オキシラトホスホニル)-α-D-グルコピラノシル]アデノシン
  • (2R,3R,4R,5R)-2-(6-アミノ-9H-プリン-9-イル)-4-{[(2R,3R,4R,5R,6R)-4,5-ビス(水素 ホスホナトオキシ)-3-ヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}-5-(ヒドロキシメチル)オキソラン-3-イル 水素 ホスファート
  • (2R,3R,4R,5R)-2-(6-amino-9H-purin-9-yl)-4-{[(2R,3R,4R,5R,6R)-4,5-bis(hydrogen phosphonatooxy)-3-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5-(hydroxymethyl)oxolan-3-yl hydrogen phosphate
Other name (1)：
  • 2′-O-(Oxylatophosphonyl)-3′-O-[3-O,4-O-bis(oxylatophosphonyl)-α-D-glucopyranosyl]adenosine
Thsaurus map：
Thesaurus Map

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