Chem
J-GLOBAL ID：200907019685841633   Nikkaji number：J1.853.893H

d6-Fexofenadine

d6-フェキソフェナジン
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： C32H33[2H]6NO4
Molecular formula furigana： C32-H39-N-O4
Molecular weight： 507.704
InChI： InChI=1S/C32H39NO4/c1-31(2,30(35)36)25-17-15-24(16-18-25)29(34)14-9-21-33-22-19-28(20-23-33)32(37,26-10-5-3-6-11-26)27-12-7-4-8-13-27/h3-8,10-13,15-18,28-29,34,37H,9,14,19-23H2,1-2H3,(H,35,36)/i1D3,2D3
InChI key： RWTNPBWLLIMQHL-WFGJKAKNSA-N
SMILES： C([2H])([2H])([2H])C(C(=O)O)(c1ccc(cc1)C(O)CCCN1CCC(CC1)C(O)(c1ccccc1)c1ccccc1)C([2H])([2H])[2H]
Systematic name  (3)：
  • 2-(2H3)メチル-2-[4-[4-[4-(ヒドロキシジフェニルメチル)ピペリジン-1-イル]-1-ヒドロキシブチル]フェニル](3,3,3-2H3)プロパン酸
  • 2-(4-{1-ヒドロキシ-4-[4-(ヒドロキシジフェニルメチル)ピペリジン-1-イル]ブチル}フェニル)-2-(2H3)メチル(2H3)プロパン酸
  • 2-(4-{1-hydroxy-4-[4-(hydroxydiphenylmethyl)piperidin-1-yl]butyl}phenyl)-2-(2H3)methyl(2H3)propanoic acid
Other name (3)：
  • 2-(2H3)Methyl-2-[4-[4-[4-(hydroxydiphenylmethyl)piperidine-1-yl]-1-hydroxybutyl]phenyl](3,3,3-2H3)propanoic acid
  • d6-Fexofenadine
  • d6-フェキソフェナジン
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