[6-[6-[[(14Z)-7-acetyloxy-8-methoxy-3,12-dimethyl-5,13-dioxo-10-(2-oxoethyl)-4,17-dioxabicyclo[14.1.0]heptadec-14-en-9-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] 3-methylbutanoate | 4564-87-8

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: [6-[6-[[(14Z)-7-acetyloxy-8-methoxy-3,12-dimethyl-5,13-dioxo-10-(2-oxoethyl)-4,17-dioxabicyclo[14.1.0]heptadec-14-en-9-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] 3-methylbutanoate
• CAS: 4564-87-8
• 化学式: C₄₂H₆₇NO₁₆
• 分子量: 842.0
• InChiKey: FQVHOULQCKDUCY-SEYXRHQNSA-N

物化性质

• 熔点：
  214°
• 比旋光度：
  D25 -58.6° (chloroform)
• 沸点：
  769.45°C (rough estimate)
• 密度：
  1.1761 (rough estimate)

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  59
• 可旋转键数：
  14
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  215
• 氢给体数：
  2
• 氢受体数：
  17

制备方法与用途

类别：有毒物质

毒性分级：中毒

急性毒性：

• 口服（小鼠）LD50: 3500 毫克/公斤
• 静脉（小鼠）LD50: 550 毫克/公斤

可燃性危险特性：热分解时排出有毒氮氧化物和烟雾

储运特性：库房低温、通风干燥保存

灭火剂：水、二氧化碳、干粉、泡沫

文献信息

• [EN] ANTIBACTERIAL COMPOUNDS<br/>[FR] COMPOSÉS ANTIBACTÉRIENS
  申请人：MASSACHUSETTS GEN HOSPITAL

  公开号：WO2019199979A1

  公开（公告）日：2019-10-17

  The present application provides compounds of formula: Methods of using these compounds for killing bacterial growth and treating bacterial infections are also provided.

  本申请提供了以下化合物的公式：还提供了使用这些化合物杀灭细菌生长和治疗细菌感染的方法。
• [EN] PROGRAMMABLE POLYMERIC DRUGS<br/>[FR] MÉDICAMENTS POLYMÈRES PROGRAMMABLES
  申请人：SONY CORP

  公开号：WO2020210689A1

  公开（公告）日：2020-10-15

  Compounds useful as biologically active compounds are disclosed. The compounds have the following structure (I): or a stereoisomer, tautomer or salt thereof, wherein R1, R2, R3, R4, R5, L, L1, L2, M and n are as defined herein. Methods associated with preparation and use of such compounds are also provided.

  披露了作为生物活性化合物有用的化合物。这些化合物具有以下结构（I）：或其立体异构体、互变异构体或盐，其中R1、R2、R3、R4、R5、L、L1、L2、M和n如本文所定义。还提供了与这些化合物的制备和使用相关的方法。
• [EN] ANTIMICROBIAL ORGANOSILANES<br/>[FR] ORGANOSILANES ANTIMICROBIENS
  申请人：TOPIKOS PHARMACEUTICALS INC

  公开号：WO2021077119A1

  公开（公告）日：2021-04-22

  Organosilicon quaternary ammonium compounds, their formulations, including powdered and solid formulations, and methods of use to treat infections in humans and animals.

  有机硅季铵化合物，它们的配方，包括粉末和固体配方，以及用于治疗人类和动物感染的方法。
• [EN] ANTIFUNGAL COMPOUNDS AND USES THEREOF<br/>[FR] COMPOSÉS ANTI-FONGIQUES ET UTILISATIONS ASSOCIÉES
  申请人：DANA FARBER CANCER INST INC

  公开号：WO2017143230A1

  公开（公告）日：2017-08-24

  Provided herein are compounds (e.g., compounds of Formulae (I), (II), and (III)) which are anti-fungal agents and can be used in the treatment of diseases, including infectious diseases. The invention provides methods of treating diseases in a subject (e.g., infectious diseases such as fungal infections), and methods of killing or inhibiting the growth of fungi in or on a subject or biological sample. The compounds may be used in subjects, in clinical settings, or in agricultural settings.

  本发明提供了化合物（例如，公式(I)、(II)和(III)的化合物），这些化合物是抗真菌剂，可用于治疗包括传染性疾病在内的疾病。本发明还提供了在主体（例如，真菌感染等传染性疾病）中治疗疾病的方法，以及杀死或抑制主体或生物样本内或上的真菌生长的方法。这些化合物可用于主体、临床环境或农业环境。
• Beta-O/S/N fatty acid based compounds as antibacterial and antiprotozoal agents
  申请人：Ludwig-Maximilians-Universität München

  公开号：EP2601941A1

  公开（公告）日：2013-06-12

  The present invention relates to beta-O/S/N fatty acids and derivatives thereof, in particular the compounds of formula (I) as described and defined herein, and their pharmaceutical use, including their use in the treatment or prevention of bacterial as well as protozoan infections, in particular the treatment or prevention of infections with Gram-positive and/or Gram-negative bacteria and infectious diseases caused by and/or related to Gram-positive and/or Gram-negative bacteria. The invention further relates to the use of these compounds for preventing or eliminating biofilms.

  本发明涉及beta-O/S/N脂肪酸及其衍生物，特别是如本文所述和定义的公式(I)化合物，及其医药用途，包括用于治疗或预防细菌以及原生动物感染，特别是治疗或预防革兰氏阳性细菌和/或革兰氏阴性细菌引起的感染和传染病以及与之相关的感染和传染病。该发明还涉及这些化合物用于预防或消除生物膜。