(-)-alpha-Noracetylmethadol | 43033-71-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: (-)-alpha-Noracetylmethadol
• 英文别名: N-desmethyl-L-α-acetyl-methadol；L-α-acetyl-N-normethadol；l-α-acetylnormethadol；nor-LAAM；levo-α-acetyl-N-normethadol；norLAAM；Noracymethadol, (-)-；[(3S,6S)-6-(methylamino)-4,4-diphenylheptan-3-yl] acetate
• CAS: 43033-71-2
• 化学式: C₂₂H₂₉NO₂
• 分子量: 339.478
• InChiKey: VWCUGCYZZGRKEE-UWJYYQICSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  25
• 可旋转键数：
  9
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  38.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  (-)-alpha-Noracetylmethadol 在 calcium sulfate 、 potassium permanganate 作用下， 以 水 、 叔丁醇 为溶剂， 生成 α-(-)-4,4-Diphenyl-6-nitro-3-heptanol-acetat
  参考文献：
  名称：

  Synthesis of a new metabolite of acetylmethadol

  摘要：

  The primary amine metabolites of alpha-(plus or minus)- alpha-(minus)-acetylmethadol were synthesized. A neutral permanganate oxidation of noracetylmethadol gave a nitroalkane. This unusual oxidation product was readily converted to the primary amine metabolite of acetylmethadol.

  DOI：

  10.1021/jm00237a010
• 作为产物：
  描述：

  [(3S,6S)-6-二甲氨基-4,4-二苯基-庚烷-3-基]乙酸酯 生成 (-)-alpha-Noracetylmethadol
  参考文献：
  名称：

  Synthesis of a new metabolite of acetylmethadol

  摘要：

  The primary amine metabolites of alpha-(plus or minus)- alpha-(minus)-acetylmethadol were synthesized. A neutral permanganate oxidation of noracetylmethadol gave a nitroalkane. This unusual oxidation product was readily converted to the primary amine metabolite of acetylmethadol.

  DOI：

  10.1021/jm00237a010

文献信息

• CARROLL F. I.; BRINE G. A.; CHEN T.; KOHL D. W.; WELCH C. D., J. ORG. CHEM. <JOCE-AH>, 1976, 41, NO 22, 3521-3524
  作者：CARROLL F. I.、 BRINE G. A.、 CHEN T.、 KOHL D. W.、 WELCH C. D.

  DOI：——

  日期：——
• Synthesis of a new metabolite of acetylmethadol
  作者：Richard N. Booher、Albert Pohland

  DOI：10.1021/jm00237a010

  日期：1975.3

  The primary amine metabolites of alpha-(plus or minus)- alpha-(minus)-acetylmethadol were synthesized. A neutral permanganate oxidation of noracetylmethadol gave a nitroalkane. This unusual oxidation product was readily converted to the primary amine metabolite of acetylmethadol.