6,7-二羟基庚酸 | 920974-78-3

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羟基酸及其衍生物
• 中文名称: 6,7-二羟基庚酸
• 英文名称: 6,7-dihydroxyheptanoic acid
• CAS: 920974-78-3
• 化学式: C₇H₁₄O₄
• 分子量: 162.186
• InChiKey: FJKVIRFMBJTEIJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.5
• 重原子数：
  11
• 可旋转键数：
  6
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  77.8
• 氢给体数：
  3
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  6,7-二羟基庚酸 、 乙酸酐 以 溶剂黄146 为溶剂， 反应 12.0h， 生成 6,7-diacetoxy-heptanoic acid
  参考文献：
  名称：

  过氧酸作为氧化剂的三氟甲磺酸催化烯烃氧化氧化和二乙酰氧基化

  摘要：

  已经开发了使用可商购的过氧酸作为氧化剂的三氟甲磺酸催化的烯烃的清洁且有效的二乙酰氧基化反应。该方法还以高产率到高产率用于不饱和羧酸的氧化内酯化。

  DOI：

  10.1021/jo202491y
• 作为产物：
  描述：

  6-庚烯酸 在 三氟甲磺酸 、 间氯过氧苯甲酸 作用下， 以 溶剂黄146 为溶剂， 生成 6,7-二羟基庚酸
  参考文献：
  名称：

  过氧酸作为氧化剂的三氟甲磺酸催化烯烃氧化氧化和二乙酰氧基化

  摘要：

  已经开发了使用可商购的过氧酸作为氧化剂的三氟甲磺酸催化的烯烃的清洁且有效的二乙酰氧基化反应。该方法还以高产率到高产率用于不饱和羧酸的氧化内酯化。

  DOI：

  10.1021/jo202491y

文献信息

• IMMUNOMODULATORY COMPOUNDS AND TREATMENT OF DISEASES RELATED TO AN OVERPRODUCTION OF INFLAMMATORY CYTOKINES
  申请人：Bauer Jacques

  公开号：US20090054378A1

  公开（公告）日：2009-02-26

  Method of using immunomodulatory compounds for treating diseases related to an overproduction of inflammatory cytokines, including diseases selected from asthma, atopic dermatitis, allergic rhinitis, prostatitis, inflammatory bowel disease, diabetes, and rhumatoid arthritis, the compounds being of general formula (I): wherein: m and n, independently from each other, are an integer ranging from 1 to 4, X and Y represent —COOH, —O—P(O)(OH) 2 , —O—SO 2 (OH), —NH 2 , —OH, —CONH(CH 2 ) n1 —NH 2 , —CO—NH—CH(COOH)—(CH 2 ) n1 —COOH, —CO—NH—CH(COOH)—(CH 2 ) n1 —NH 2 , —O—CO—(CH 2 ) n1 —NH 2 , —O—CO—(CH 2 ) n1 —CHOH—CH 2 OH, —O—CO—(CH 2 ) n1 —OH, O—CO—(CH 2 ) n1 —COOH, —O—CO—(CH 2 ) n1 —CHO, —O—CO—(CH 2 ) n1 —NH—CO—(CH 2 ) n2 —COOH, R 1 and R 2 each designate an acyl group derived from a saturated or unsaturated, straight- or branched-chain carboxylic acid having from 2 to 18 carbon atoms, which is unsubstituted or bears one to three substituents selected among hydroxyl, dihydroxyphosphoryloxy, alkyl of 2 to 10 carbon atoms, alkoxy of 2 to 10 carbon atoms, acyloxy of 2 to 18 carbon atoms in the acyl moiety, amino, acylamino.

  使用免疫调节化合物治疗与炎症细胞因子过度产生相关的疾病的方法，包括从哮喘、特应性皮炎、过敏性鼻炎、前列腺炎、炎症性肠病、糖尿病和类风湿关节炎中选择的疾病，所述化合物具有通式(I)：其中：m和n分别独立于彼此，为1至4之间的整数，X和Y代表—COOH，—O—P(O)(OH)2，—O—SO2(OH)，—NH2，—OH，—CONH(CH2)n1—NH2，—CO—NH—CH(COOH)—(CH2)n1—COOH，—CO—NH—CH(COOH)—(CH2)n1—NH2，—O—CO—(CH2)n1—NH2，—O—CO—(CH2)n1—CHOH—CH2OH，—O—CO—(CH2)n1—OH，O—CO—(CH2)n1—COOH，—O—CO—(CH2)n1—CHO，—O—CO—(CH2)n1—NH—CO—(CH2)n2—COOH，R1和R2各自指代从饱和或不饱和、直链或支链的具有2至18个碳原子的羧酸衍生的酰基，该酰基未取代或带有1到3个在2到10个碳原子的烷基、2到10个碳原子的烷氧基、2到18个碳原子的酰氧基在酰基部分、氨基、酰氨基中选择的取代基。
• Novel acyl-dipeptide-like compounds bearing an accessory functional side chain spacer, a method for preparing the same and pharmaceutical compositions containing such products
  申请人：Bauer Jacques

  公开号：US20050192232A1

  公开（公告）日：2005-09-01

  The present invention is directed in particular to dipeptide-like compounds derived from functionally substituted amino acids, having fatty acid chains bound thereto through amidification of the amine functional groups of said dipeptide-like compounds, one end portion of which bears an accessory functional side chain spacer, with the other end portion being an acid group either in neutral or charged state. Compounds of the present invention have immunomodulating properties like adjuvants, In addition, compounds of the invention can be grafted on a given antigen in order to modulate or tune the immune response or can be equally grafted on a pharmaceutical carrier to enhance the therapeutic effect or targetting thereof. Accordingly, compounds of the invention find use in human and veterinary medicine both as immunogens and diagnostic tools.

  该发明特别涉及类二肽样化合物，这些化合物源自功能性取代的氨基酸，通过酰胺化作用将脂肪酸链结合到所述类二肽样化合物的氨基官能团上，其中一端部分带有辅助功能侧链间隔物，另一端部分是酸基，可以是中性或带电状态。该发明的化合物具有类似佐剂的免疫调节特性。此外，该发明的化合物可以嫁接到给定抗原上，以调节或调整免疫反应，也可以嫁接到药物载体上，以增强治疗效果或靶向效果。因此，该发明的化合物在人类和兽医医学中均可用作免疫原和诊断工具。
• Acyl pseudodipeptides which carry a functionalised auxialiary arm
  申请人：——

  公开号：US20030203852A1

  公开（公告）日：2003-10-30

  The present invention is directed in particular to dipeptide-like compounds derived from functionally substituted amino acids, having fatty acid chains bound thereto through amidification of the amine functional groups of said dipeptide-like compounds, one end portion of which bears an accessory functional side chain spacer, with the other end portion being an acid group either in neutral or charged state. Compounds of the present invention have immunomodulating properties like adjuvants, In addition, compounds of the invention can be grafted on a given antigen in order to modulate or tune the immune response or can be equally grafted on a pharmaceutical carrier to enhance the therapeutic effect or targetting thereof. Accordingly, compounds of the invention find use in human and veterinary medicine both as immunogens and diagnostic tools.

  本发明特别涉及从功能性取代氨基酸衍生的二肽样化合物，其通过酰胺化作用将脂肪酸链结合到所述二肽样化合物的氨基功能团上，其中一端部分带有附属功能侧链间隔物，另一端部分是酸基，可以是中性或带电状态。本发明的化合物具有类似佐剂的免疫调节性质。此外，本发明的化合物可以嫁接到给定抗原上，以调节或调整免疫应答，或者可以嫁接到药物载体上，以增强治疗效果或靶向作用。因此，本发明的化合物在人类和兽医医学中均可用作免疫原和诊断工具。
• ACYL PSEUDOPEPTIDES WHICH CARRY A FUNCTIONALIZED AUXILIARY ARM
  申请人：BAUER Jacques

  公开号：US20130022628A1

  公开（公告）日：2013-01-24

  The present invention is directed in particular to dipeptide-like compounds derived from functionally substituted amino acids, having fatty acid chains bound thereto through amidification of the amine functional groups of said dipeptide-like compounds, one end portion of which bears an accessory functional side chain spacer, with the other end portion being an acid group either in neutral or charged state. Compounds of the present invention have immunomodulating properties like adjuvants. In addition, compounds of the invention can be grafted on a given antigen in order to modulate or tune the immune response or can be equally grafted on a pharmaceutical carrier to enhance the therapeutic effect or targeting thereof. Accordingly, compounds of the invention find use in human and veterinary medicine both as immunogens and diagnostic tools.

  本发明特别针对从功能取代的氨基酸中衍生出来的二肽类化合物，其通过酰胺化作用将脂肪酸链结合到所述二肽类化合物的胺基官能团上，其中一端部分具有辅助功能侧链间隔物，而另一端部分是一个酸基，可以是中性或带电状态。本发明的化合物具有类似佐剂的免疫调节特性。此外，本发明的化合物可以嫁接到给定的抗原上，以调节或调整免疫反应，也可以同样嫁接到药物载体上，以增强其治疗效果或靶向性。因此，本发明的化合物在人类和兽医医学中均可用作免疫原和诊断工具。
• ACYL PSEUDODIPEPTIDES WHICH CARRY A FUNCTIONALIZED AUXILIARY ARM
  申请人：BAUER Jacques

  公开号：US20100215685A1

  公开（公告）日：2010-08-26

  The present invention is directed in particular to dipeptide-like compounds derived from functionally substituted amino acids, having fatty acid chains bound thereto through amidification of the amine functional groups of said dipeptide-like compounds, one end portion of which bears an accessory functional side chain spacer, with the other end portion being an acid group either in neutral or charged state. Compounds of the present invention have immunomodulating properties like adjuvants, In addition, compounds of the invention can be grafted on a given antigen in order to modulate or tune the immune response or can be equally grafted on a pharmaceutical carrier to enhance the therapeutic effect or targeting thereof. Accordingly, compounds of the invention find use in human and veterinary medicine both as immunogens and diagnostic tools.

  本发明特别针对从功能取代氨基酸衍生的二肽类化合物，其通过酰胺化反应将脂肪酸链结合到所述二肽类化合物的胺基官能团上，其中一端部分具有辅助功能侧链间隔物，而另一端部分是中性或带电酸基。本发明的化合物具有免疫调节特性，如辅助剂。此外，本发明的化合物可以嫁接到给定的抗原上，以调节或调整免疫反应，也可以同样嫁接到药物载体上，以增强其治疗效果或靶向作用。因此，本发明的化合物在人类和兽医学中均可用作免疫原和诊断工具。