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methyl 8-(5-(2-acetoxyoctyl)-1,3-dioxolan-4-yl)octanoate | 1269416-81-0

中文名称
——
中文别名
——
英文名称
methyl 8-(5-(2-acetoxyoctyl)-1,3-dioxolan-4-yl)octanoate
英文别名
——
methyl 8-(5-(2-acetoxyoctyl)-1,3-dioxolan-4-yl)octanoate化学式
CAS
1269416-81-0
化学式
C22H40O6
mdl
——
分子量
400.556
InChiKey
YCBXTQVGRHXKBE-QNGMFEMESA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    4.92
  • 重原子数:
    28.0
  • 可旋转键数:
    16.0
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.91
  • 拓扑面积:
    71.06
  • 氢给体数:
    0.0
  • 氢受体数:
    6.0

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为产物:
    描述:
    聚合甲醛methyl (12R)-acetoxy-9,10-dihydroxyoctadecanoate磷酸 作用下, 反应 4.0h, 以40%的产率得到methyl 8-(5-(2-acetoxyoctyl)-1,3-dioxolan-4-yl)octanoate
    参考文献:
    名称:
    Antioxidant, anti-inflammatory and anti-hyperglycaemic activities of heterocyclic homoprostanoid derivatives
    摘要:
    A series of 19 heterocyclic homoprostanoids were synthesized from easily available oleic and ricinoleic acids and evaluated for their possible antioxidant, anti-inflammatory and anti-hyperlipidaemic activities. Compounds with thioxo- and oxoimidazole ring (1) and (2) have shown potent antioxidant activity with IC(50) values 0.23 +/- 0.09 and 0.41 +/- 0.01 mM comparable with standard ascorbic acid. Compound (3) with a quinoxaline ring showed maximum inhibition of BSA denaturation at 1 mM concentration and comparable with standard diclofenac. Incorporation of electron withdrawing substitutions like chloro- and nitro-groups in the quinoxaline ring has resulted in an increase anti-inflammatory activity. Test compounds (3), (3a) and (3c) showed modest inhibition of DPP-IV in vitro. However, the unsubstituted quinoxaline (3) and substituted quinoxalines (3b and 3c) reduced plasma glucose levels indicating the presence of hypoglycemic activity. (C) 2010 Elsevier Ltd. All rights reserved.
    DOI:
    10.1016/j.bmc.2010.11.016
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