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3-吲哚基-beta-D-葡糖苷酸环己胺盐 | 35804-66-1

中文名称
3-吲哚基-beta-D-葡糖苷酸环己胺盐
中文别名
——
英文名称
Indoxyl glucuronide
英文别名
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(1H-indol-3-yloxy)oxane-2-carboxylic acid
3-吲哚基-beta-D-葡糖苷酸环己胺盐化学式
CAS
35804-66-1
化学式
C14H15NO7
mdl
——
分子量
309.27
InChiKey
KUYNOZVWCFXSNE-BYNIDDHOSA-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

物化性质

  • 沸点:
    669.0±55.0 °C(Predicted)
  • 密度:
    1.693±0.06 g/cm3(Predicted)
  • 物理描述:
    Solid
  • 稳定性/保质期:

    遵照规定使用和储存,则不会发生分解。

计算性质

  • 辛醇/水分配系数(LogP):
    0.1
  • 重原子数:
    22
  • 可旋转键数:
    3
  • 环数:
    3.0
  • sp3杂化的碳原子比例:
    0.36
  • 拓扑面积:
    132
  • 氢给体数:
    5
  • 氢受体数:
    7

ADMET

代谢
尿素毒素倾向于通过饮食过量或肾脏过滤不良在血液中积聚。大多数尿素毒素是代谢废物,通常通过尿液或粪便排出。
Uremic toxins tend to accumulate in the blood either through dietary excess or through poor filtration by the kidneys. Most uremic toxins are metabolic waste products and are normally excreted in the urine or feces.
来源:Toxin and Toxin Target Database (T3DB)
毒理性
  • 毒性总结
尿毒症毒素,如吲哚基-β-D-葡萄糖苷酸,通过有机离子转运蛋白(尤其是OAT3)被积极运输到肾脏中。尿毒症毒素平的增加可以刺激活性氧种类的产生。这似乎是通过尿毒症毒素直接结合或抑制NADPH氧化酶(尤其是肾脏和心脏中丰富的NOX4)来介导的(A7868)。活性氧种类可以诱导几种不同的DNA甲基转移酶(DNMTs),这些酶参与沉默一种名为KLOTHO的蛋白质。KLOTHO已被确定在抗衰老、矿物质代谢和维生素D代谢中发挥重要作用。许多研究指出,在急性或慢性肾脏疾病中,由于局部活性氧种类平升高,KLOTHO mRNA和蛋白平会降低(A7869)。
Uremic toxins such as indoxyl-beta-D-glucuronide are actively transported into the kidneys via organic ion transporters (especially OAT3). Increased levels of uremic toxins can stimulate the production of reactive oxygen species. This seems to be mediated by the direct binding or inhibition by uremic toxins of the enzyme NADPH oxidase (especially NOX4 which is abundant in the kidneys and heart) (A7868). Reactive oxygen species can induce several different DNA methyltransferases (DNMTs) which are involved in the silencing of a protein known as KLOTHO. KLOTHO has been identified as having important roles in anti-aging, mineral metabolism, and vitamin D metabolism. A number of studies have indicated that KLOTHO mRNA and protein levels are reduced during acute or chronic kidney diseases in response to high local levels of reactive oxygen species (A7869).
来源:Toxin and Toxin Target Database (T3DB)
毒理性
  • 致癌物分类
对人类不具有致癌性(未列入国际癌症研究机构名录)。
No indication of carcinogenicity to humans (not listed by IARC).
来源:Toxin and Toxin Target Database (T3DB)
毒理性
  • 健康影响
长期暴露于尿毒症毒素可能会导致多种疾病,包括肾脏损伤、慢性肾病和心血管疾病。
Chronic exposure to uremic toxins can lead to a number of conditions including renal damage, chronic kidney disease and cardiovascular disease.
来源:Toxin and Toxin Target Database (T3DB)
毒理性
  • 暴露途径
内源性的,摄入,皮肤(接触)
Endogenous, Ingestion, Dermal (contact)
来源:Toxin and Toxin Target Database (T3DB)
毒理性
  • 症状
作为尿毒症毒素,这种化合物可以导致尿毒症综合征。尿毒症综合征可能影响身体的任何部位,并可能导致恶心、呕吐、食欲丧失和体重减轻。它还可能引起精神状态的变化,如混乱、意识降低、激动、精神疾病、癫痫和昏迷。异常出血也可能发生,例如在非常轻微的损伤后自发或大量出血。心脏问题,如心律不齐、心脏周围囊炎症(心包炎)和心脏压力增加,也可能出现在尿毒症综合征患者中。由于肺部和胸壁之间空间(胸腔积液)的液体积聚导致的呼吸急促也可能出现。
As a uremic toxin, this compound can cause uremic syndrome. Uremic syndrome may affect any part of the body and can cause nausea, vomiting, loss of appetite, and weight loss. It can also cause changes in mental status, such as confusion, reduced awareness, agitation, psychosis, seizures, and coma. Abnormal bleeding, such as bleeding spontaneously or profusely from a very minor injury can also occur. Heart problems, such as an irregular heartbeat, inflammation in the sac that surrounds the heart (pericarditis), and increased pressure on the heart can be seen in patients with uremic syndrome. Shortness of breath from fluid buildup in the space between the lungs and the chest wall (pleural effusion) can also be present.
来源:Toxin and Toxin Target Database (T3DB)

安全信息

  • 危险品标志:
    Xi
  • 安全说明:
    S24/25,S26,S36
  • 危险类别码:
    R36/37/38
  • WGK Germany:
    3
  • 海关编码:
    29349990,2933990090

文献信息

  • Method for detecting Escherichia coli in a sample
    申请人:3M INNOVATIVE PROPERTIES COMPANY
    公开号:US10023898B2
    公开(公告)日:2018-07-17
    A method of detecting Listeria monocytogenes. The method comprises providing a culture device with a selective culture medium and a detection article comprising a first indicator system. The selective culture medium facilitates the growth of Listeria microorganisms. When a Listeria microorganism is detected in a sample contacted with the culture medium, the detection article is contacted with the culture medium to detect Listeria monocytogenes.
    一种检测李斯特菌的方法。该方法包括提供一个带有选择性培养基的培养装置和一个包含第一指示系统的检测物品。选择性培养基有利于李斯特菌微生物的生长。当在与培养基接触的样品中检测到李斯特菌微生物时,检测物品与培养基接触以检测单增李斯特菌。
  • Method for detecting a Shigella or Cronobacter microorganism
    申请人:3M INNOVATIVE PROPERTIES COMPANY
    公开号:US10619181B2
    公开(公告)日:2020-04-14
    A method of detecting a Shigella or Cronobacter microorganism. The method comprises providing a culture device with a selective culture medium and a detection article comprising a first indicator system.
    一种检测志贺氏菌或克罗诺斯菌微生物的方法。该方法包括提供一个带有选择性培养基的培养装置和一个包含第一指示系统的检测物品。
  • Automated imaging and harvesting of colonies on thin film culture devices
    申请人:3M Innovative Properties Company
    公开号:US20020110906A1
    公开(公告)日:2002-08-15
    Thin film culture devices are described that have positioning structures, as well as methods for harvesting cells from colonies on the culture device based on location of colonies on the device relative to the positioning structures. In addition, a computer readable medium encoded with a computer program is described that identifies position of colonies relative to the positioning structures.
    本文介绍了具有定位结构的薄膜培养装置,以及根据培养装置上菌落相对于定位结构的位置从菌落中收获细胞的方法。此外,还介绍了一种用计算机程序编码的计算机可读介质,可识别菌落相对于定位结构的位置。
  • Microbial B-glucuronidase genes, gene production and uses thereof
    申请人:CAMBIA
    公开号:US20030157684A1
    公开(公告)日:2003-08-21
    Genes encoding microbial &bgr;-glucuronidase and protein that is secreted and its uses are provided.
    提供了编码微生物&bgr;-葡糖醛酸酶和分泌蛋白的基因及其用途。
  • PRECIPITATE TEST FOR MICROORGANISMS
    申请人:BioControl Systems, Incorporated
    公开号:EP0470172A1
    公开(公告)日:1992-02-12
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