Chem
J-GLOBAL ID：201307066540958541   Nikkaji number：J3.186.590E

5-(3-Hydroxyphenyl)-8,8-dimethyl-10-[9-(2-hydroxy-3-phenoxypropyl)-9H-purine-6-yl]-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione

5-(3-ヒドロキシフェニル)-8,8-ジメチル-10-[9-(2-ヒドロキシ-3-フェノキシプロピル)-9H-プリン-6-イル]-5,8,9,10-テトラヒドロピリミド[4,5-b]キノリン-2,4,6(1H,3H,7H)-トリオン
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： C33H31N7O6
Molecular formula furigana： C33-H31-N7-O6
Molecular weight： 621.654
InChI： InChI=1S/C33H31N7O6/c1-33(2)12-22-25(23(43)13-33)24(18-7-6-8-19(41)11-18)26-28(37-32(45)38-31(26)44)40(22)30-27-29(34-16-35-30)39(17-36-27)14-20(42)15-46-21-9-4-3-5-10-21/h3-11,16-17,20,24,41-42H,12-15H2,1-2H3,(H2,37,38,44,45)
InChI key： CAUKAAPHCKEONN-UHFFFAOYSA-N
SMILES： CC1(C)CC(=O)C2=C(C1)N(c1[nH]c(=O)[nH]c(=O)c1C2c1cccc(O)c1)c1ncnc2n(CC(O)COc3ccccc3)cnc12
Systematic name  (3)：
  • 5-(3-ヒドロキシフェニル)-8,8-ジメチル-10-[9-(2-ヒドロキシ-3-フェノキシプロピル)-9H-プリン-6-イル]-5,8,9,10-テトラヒドロピリミド[4,5-b]キノリン-2,4,6(1H,3H,7H)-トリオン
  • 10-[9-(2-ヒドロキシ-3-フェノキシプロピル)-9H-プリン-6-イル]-5-(3-ヒドロキシフェニル)-8,8-ジメチル-1H,2H,3H,4H,5H,6H,7H,8H,9H,10H-ピリミド[4,5-b]キノリン-2,4,6-トリオン
  • 10-[9-(2-hydroxy-3-phenoxypropyl)-9H-purin-6-yl]-5-(3-hydroxyphenyl)-8,8-dimethyl-1H,2H,3H,4H,5H,6H,7H,8H,9H,10H-pyrimido[4,5-b]quinoline-2,4,6-trione
Other name (1)：
  • 5-(3-Hydroxyphenyl)-8,8-dimethyl-10-[9-(2-hydroxy-3-phenoxypropyl)-9H-purine-6-yl]-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
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