Chem
J-GLOBAL ID：200907012377083308   Nikkaji number：J1.521.188A

NMDBA

N6-(1-ナフタレンメチル)-2′-デオキシ-2′-(3,5-ジメトキシベンズアミド)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： C30H30N6O6
Molecular formula furigana： C30-H30-N6-O6
Molecular weight： 570.606
InChI： InChI=1S/C30H30N6O6/c1-40-20-10-19(11-21(12-20)41-2)29(39)35-24-26(38)23(14-37)42-30(24)36-16-34-25-27(32-15-33-28(25)36)31-13-18-8-5-7-17-6-3-4-9-22(17)18/h3-12,15-16,23-24,26,30,37-38H,13-14H2,1-2H3,(H,35,39)(H,31,32,33)/t23-,24-,26-,30-/m1/s1
InChI key： OARVXDFNTLYMCJ-JVUUKAHWSA-N
SMILES： COc1cc(OC)cc(c1)C(=O)N[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(NCc3cccc4ccccc34)ncnc12
Systematic name  (4)：
  • N-(1-ナフチルメチル)-2′-デオキシ-2′-(3,5-ジメトキシベンゾイルアミノ)アデノシン
  • N-(1-ナフチルメチル)-2′-(3,5-ジメトキシベンゾイルアミノ)-2′-デオキシアデノシン
  • N-[(2R,3R,4S,5R)-4-ヒドロキシ-5-(ヒドロキシメチル)-2-(6-{[(ナフタレン-1-イル)メチル]アミノ}-9H-プリン-9-イル)オキソラン-3-イル]-3,5-ジメトキシベンズアミド
  • N-[(2R,3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-(6-{[(naphthalen-1-yl)methyl]amino}-9H-purin-9-yl)oxolan-3-yl]-3,5-dimethoxybenzamide
Other name (5)：
  • N-(1-Naphthylmethyl)-2′-deoxy-2′-(3,5-dimethoxybenzoylamino)adenosine
  • NMDBA
  • N6-(1-ナフタレンメチル)-2′-デオキシ-2′-(3,5-ジメトキシベンズアミド)アデノシン
  • N6-(1-Naphthalenemethyl)-2′-deoxy-2′-(3,5-dimethoxybenzamido)adenosine
  • N-(1-Naphthylmethyl)-2′-(3,5-dimethoxybenzoylamino)-2′-deoxyadenosine
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