16-(2-Hydroxy-3,3-dimethylbutan-2-yl)-15-methoxy-13-oxa-5-azahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11-trien-11-ol

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• 英文名称: 16-(2-Hydroxy-3,3-dimethylbutan-2-yl)-15-methoxy-13-oxa-5-azahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11-trien-11-ol
• 化学式: C₂₅H₃₅NO₄
• 分子量: 413.5
• InChiKey: YOYLLRBMGQRFTN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  30
• 可旋转键数：
  3
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.76
• 拓扑面积：
  71
• 氢给体数：
  3
• 氢受体数：
  5

文献信息

• [EN] ORVINOL AND THEVINOL DERIVATIVES USEFUL IN THE TREATMENT OF DRUG AND ALCOHOL ABUSE<br/>[FR] DÉRIVÉS D'ORVINOL ET DE THÉVINOL UTILES DANS LE TRAITEMENT DE LA TOXICOMANIE ET DE L'ALCOOLISME
  申请人：UNIV BATH

  公开号：WO2013007986A1

  公开（公告）日：2013-01-17

  The invention provides orvinol and thevinol compounds useful for the treatment of drug and alcohol abuse, the compounds being particularly useful for the prevention of relapse in recovering addicts.

  这项发明提供了对药物和酒精滥用治疗有用的奥维诺尔和西维诺尔化合物，这些化合物特别适用于帮助康复成瘾者预防复发。
• ORVINOL AND THEVINOL DERIVATIVES USEFUL IN THE TREATMENT OF DRUG AND ALCOHOL ABUSE
  申请人：Lewis John

  公开号：US20140213603A1

  公开（公告）日：2014-07-31

  The invention provides orvinol and thevinol compounds useful for the treatment of drug and alcohol abuse, the compounds being particularly useful for the prevention of relapse in recovering addicts.

  这项发明提供了用于治疗药物和酒精滥用的奥维诺尔（orvinol）和西维诺尔（thevinol）化合物，这些化合物特别适用于预防康复成瘾者的复发。
• METHODS AND COMPOSITIONS FOR PREVENTING OPIOID ABUSE
  申请人：Waterville Valley Technologies, Inc.

  公开号：US20160326182A1

  公开（公告）日：2016-11-10

  Abuse-resistant opioid compounds, drug delivery systems, pharmaceutical compositions comprising an opioid covalently bound to a chemical moiety are provided. Methods of delivering an active ingredient to a subject and methods of preventing opioid abuse are also provided.

  提供了耐滥用的阿片类化合物、药物输送系统、含有阿片类药物与化学基团共价结合的制药组合物。还提供了将活性成分输送给受试者的方法以及预防阿片类药物滥用的方法。
• Preparation of 10-Keto Morphinans by Benzylic Oxidation
  申请人：Sun Hang

  公开号：US20110071296A1

  公开（公告）日：2011-03-24

  The present invention provides processes for the preparation of 10-keto and/or 10-hydroxy morphinans. In particular, the invention provides to processes for preparing a 10-keto morphinan by chromium-catalyzed benzylic oxidation of a morphinan with a periodic acid.

  本发明提供了制备10-酮基和/或10-羟基吗啡酮类化合物的方法。具体而言，该发明提供了一种通过铬催化苯基氧化吗啡酮类化合物以制备10-酮基吗啡酮的方法。
• Demethylation of Reticuline and Derivatives Thereof with Fungal Cytochrome P450
  申请人：River Stone Biotech APS

  公开号：US20210230655A1

  公开（公告）日：2021-07-29

  The invention relates to recombinant host cells that expresses one or more genes encoding a cytochrome P450 enzyme capable of N-demethylating and/O-demethylating reticuline and/or derivatives thereof, and also methods of producing a N-demethylated and/or O-demethylated reticuline and/or derivatives thereof, comprising cultivating the recombinant host of the invention in a culture medium under conditions in which the one or more genes encoding the cytochrome P450 enzymes is/are expressed. The reticuline and derivatives thereof are useful for providing access to naturally unavailable and chemically difficult-to-produce starting materials for opioids.

  该发明涉及重组宿主细胞，该细胞表达一个或多个编码细胞色素P450酶的基因，该酶能够对莱角碱和/或其衍生物进行N-去甲基化和/或O-去甲基化，并且还涉及生产N-去甲基化和/或O-去甲基化的莱角碱和/或其衍生物的方法，包括在培养基中培养该发明的重组宿主细胞，在该条件下，编码细胞色素P450酶的一个或多个基因被表达。莱角碱及其衍生物可用于提供自然无法获得和化学上难以生产的阿片类药物的起始物质。