Chem
J-GLOBAL ID:200907027168409996   Nikkaji number:J2.330.345K

9-(2-O,3-O,5-O-Triacetyl-β-D-ribofuranosyl)-6-(4,5-diphenyl-1H-imidazole-1-yl)-2-chloro-9H-purine

9-(2-O,3-O,5-O-トリアセチル-β-D-リボフラノシル)-6-(4,5-ジフェニル-1H-イミダゾール-1-イル)-2-クロロ-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: C31H27ClN6O7
Molecular formula furigana: C31-H27-CL-N6-O7
Molecular weight: 631.040
InChI: InChI=1S/C31H27ClN6O7/c1-17(39)42-14-22-26(43-18(2)40)27(44-19(3)41)30(45-22)38-16-34-24-28(35-31(32)36-29(24)38)37-15-33-23(20-10-6-4-7-11-20)25(37)21-12-8-5-9-13-21/h4-13,15-16,22,26-27,30H,14H2,1-3H3/t22-,26-,27-,30-/m1/s1
InChI key: MUOAQHDQGDNGSU-QJUVTUJLSA-N
SMILES: CC(=O)OC[C@H]1O[C@H]([C@H](OC(=O)C)[C@@H]1OC(=O)C)n1cnc2c(nc(Cl)nc12)n1cnc(c1c1ccccc1)c1ccccc1
Systematic name  (3):
  • 9-(2-O,3-O,5-O-トリアセチル-β-D-リボフラノシル)-6-(4,5-ジフェニル-1H-イミダゾール-1-イル)-2-クロロ-9H-プリン
  • [(2R,3R,4R,5R)-3,4-ビス(アセチルオキシ)-5-[2-クロロ-6-(4,5-ジフェニル-1H-イミダゾール-1-イル)-9H-プリン-9-イル]オキソラン-2-イル]メチル アセタート
  • [(2R,3R,4R,5R)-3,4-bis(acetyloxy)-5-[2-chloro-6-(4,5-diphenyl-1H-imidazol-1-yl)-9H-purin-9-yl]oxolan-2-yl]methyl acetate
Other name (1):
  • 9-(2-O,3-O,5-O-Triacetyl-β-D-ribofuranosyl)-6-(4,5-diphenyl-1H-imidazole-1-yl)-2-chloro-9H-purine
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