17-甲基吗喃 | 3882-38-0

• 分子结构分类: 有机化合物 - 生物碱及其衍生物 - 吗啡烷
• 中文名称: 17-甲基吗喃
• 英文名称: (+)-17-methylmorphinan
• 英文别名: N-Methylmorphinan；(1R,9R,10R)-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2,4,6-triene
• CAS: 3882-38-0
• 化学式: C₁₇H₂₃N
• 分子量: 241.376
• InChiKey: IHBSVVZENGBQDY-BBWFWOEESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  18
• 可旋转键数：
  0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  3.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  17-甲基吗喃 、 乙酰氯 生成 (-)-3-acetyl-N-methylmorphinan
  参考文献：
  名称：

  MOHACSI, E.

  摘要：

  DOI：
• 作为产物：
  描述：

  (-)-N-methylmorphinan-6-one 在 一水合肼 作用下， 以 various solvent(s) 为溶剂， 以95%的产率得到17-甲基吗喃
  参考文献：
  名称：

  Schmidhammer, Helmut; Jacobson, Arthur E.; Brossi, Arnold, Heterocycles, 1982, vol. 17, p. 391 - 394

  摘要：

  DOI：

文献信息

• Combination of benzyl-4, 5-dihydro-1H-imidazole derivative and an opioid receptor ligand
  申请人：Laboratorios del Dr. Esteve S.A.

  公开号：EP2014288A1

  公开（公告）日：2009-01-14

  The present invention refers to a combination of a Compound A, a benzyl-4,5-dihydro-1 H-imidazole derivative according to formula (I) and a Compound B, an opioid receptor ligand; especially of xylometazoline or oxymetazoline and a µ-opioid receptor agonist, most preferably of xylometazoline or oxymetazoline and morphine; a medicament comprising this combination; a pharmaceutical formulation for nasal application comprising this combination; or the use of this combination for the treatment of the symptoms of pain, or the prevention or the prophylaxis of the symptoms of pain, whereas pain particularily encompasses visceral pain, chronic pain, cancer pain, acute pain or neuropathic pain, specifically involving also breakthrough pain.

  本发明涉及一种化合物A，即按照式(I)的苄基-4,5-二氢-1H-咪唑衍生物和一种化合物B，一种阿片受体配体的组合；特别是甲苯鼻塞或鼻塞通或一种μ-阿片受体激动剂，最好是甲苯鼻塞或鼻塞通和吗啡；包括这种组合的药物；包括这种组合的鼻用制剂；或者使用这种组合治疗疼痛症状，或者预防或预防疼痛症状，其中疼痛特别包括内脏疼痛、慢性疼痛、癌症疼痛、急性疼痛或神经病理性疼痛，特别还涉及突破性疼痛。
• [EN] COMPOSITIONS AND METHODS THEREOF<br/>[FR] COMPOSITIONS ET PROCÉDÉS ASSOCIÉS
  申请人：EXCIVA UG HAFTUNGSBESCHRAENKT

  公开号：WO2018039642A1

  公开（公告）日：2018-03-01

  Compounds of formula I, (I) or enantiomers thereof, metabolites thereof, derivatives thereof, deuterated derivatives thereof, halogenated derivatives thereof, prodrugs thereof, pharmaceutically acceptable salts thereof, N- oxides thereof, or a combination thereof, processes and intermediates for preparation thereof, compositions thereof, and uses thereof, are provided. Pharmaceutical compositions comprising a compound of formula I and a compound of Formula II: (IIa) (IIb) or enantiomers thereof, metabolites thereof, derivatives thereof, deuterated derivatives thereof, prodrugs thereof, pharmaceutically acceptable salts thereof, N-oxides thereof, or a combination thereof. Compositions and methods for improving the efficacy of DEX, or providing beneficial pharmacokinetic effects to DEX, comprising co-administering a compound of formula I or SARPO, and a compound of Formula II or DEX to a subject in need thereof, and dosage forms, drug delivery systems, methods of treatment thereof.

  提供具有公式I的化合物(I)或其对应异构体、代谢物、衍生物、氘化衍生物、卤化衍生物、前药、药用可接受盐、N-氧化物或其组合，以及它们的制备过程和中间体、组合物和使用方法。包含公式I化合物的药物组合物以及公式II的化合物(IIa) (IIb)或其对应异构体、代谢物、衍生物、氘化衍生物、前药、药用可接受盐、N-氧化物或其组合。包含共给予需要该物质的受试者公式I化合物或SARPO和公式II化合物或DEX的DEX效能改进或提供DEX有益药代动力学效果的组合物和方法，以及剂量形式、药物传递系统、治疗方法。
• METHODS FOR N-DEMETHYLATION OF MORPHINE AND TROPANE ALKALOIDS
  申请人：Carroll Robert James

  公开号：US20090005564A1

  公开（公告）日：2009-01-01

  The present invention provides a method for the N-demethylation of an N-methylated heterocycle, particularly a morphine or tropane alkaloid or derivative thereof. The method comprises reacting the heterocycle with a metal catalyst and a solvent in the presence of an oxidizing agent.

  本发明提供了一种用于N-去甲基化N-甲基杂环化合物的方法，特别是吗啡或曲柳生物碱或其衍生物。该方法包括在氧化剂存在下，将杂环化合物与金属催化剂和溶剂反应。
• METHODS FOR ONE-POT N-DEMETHYLATION/N-ACYLATION OF MORPHINE AND TROPANE ALKALOIDS
  申请人：Carroll Robert James

  公开号：US20090005565A1

  公开（公告）日：2009-01-01

  The present invention provides a method for the N-demethylation and/or N-acylation of an N-methylated heterocycle such as morphine alkaloids or tropane alkaloids. The method comprises reacting the heterocycle with an acylating agent in the presence of a metal catalyst.

  本发明提供了一种用于对N-甲基杂环化合物（如吗啡生物碱或曲梨生物碱）进行N-去甲基化和/或N-酰化的方法。该方法包括在金属催化剂存在下将杂环化合物与酰化剂反应。
• Combination of a 5-HT7 receptor ligand and an opioid receptor ligand
  申请人：Laboratorios del Dr. Esteve S.A.

  公开号：EP1997493A1

  公开（公告）日：2008-12-03

  The present invention refers to a combination of a 5HT7 receptor ligand and an opioid recptor ligand, especially of a 5HT7 receptor agonist and an opioid recptor agonist, a medicament comprising this combination, or the use of this combination for the treatment of the symptoms of pain, the prevention or the prophylaxis of the symptoms of pain.

  本发明涉及一种5HT7受体配体和阿片受体配体的组合，特别是一种5HT7受体激动剂和阿片受体激动剂，包含该组合的药物，或者利用该组合治疗疼痛症状，预防或预防疼痛症状的用途。