Chem
J-GLOBAL ID：201207076880051840   Nikkaji number：J2.998.949D

9-[β-D-Ribofuranosyl]-6-methoxy-2-[4-(nitrooxy)butyloxy]-9H-purine

9-[β-D-リボフラノシル]-6-メトキシ-2-[4-(ニトロオキシ)ブチルオキシ]-9H-プリン
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： C15H21N4[N+]O8[O-]
Molecular formula furigana： C15-H21-N5-O9
Molecular weight： 415.359
InChI： InChI=1S/C15H21N5O9/c1-26-13-9-12(17-15(18-13)27-4-2-3-5-28-20(24)25)19(7-16-9)14-11(23)10(22)8(6-21)29-14/h7-8,10-11,14,21-23H,2-6H2,1H3/t8-,10-,11-,14-/m1/s1
InChI key： VIAWWUDHYMXSPA-IDTAVKCVSA-N
SMILES： COc1nc(OCCCCO[N+](=O)[O-])nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Systematic name  (3)：
  • 9-[β-D-リボフラノシル]-6-メトキシ-2-[4-(ニトロオキシ)ブチルオキシ]-9H-プリン
  • 4-({9-[(2R,3R,4S,5R)-3,4-ジヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]-6-メトキシ-9H-プリン-2-イル}オキシ)ブチル ニトラート
  • 4-({9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-methoxy-9H-purin-2-yl}oxy)butyl nitrate
Other name (1)：
  • 9-[β-D-Ribofuranosyl]-6-methoxy-2-[4-(nitrooxy)butyloxy]-9H-purine
Thsaurus map：
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