2-((3-(tert-butoxy)-3-oxopropyl)amino)acetic acid | 174799-87-2

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 2-((3-(tert-butoxy)-3-oxopropyl)amino)acetic acid
• 英文别名: 6-tert-butyl hydrogen 3-azahexanedioate；t-Butoxycarbonylethylaminoacetic acid；2-[[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]amino]acetic acid
• CAS: 174799-87-2
• 化学式: C₉H₁₇NO₄
• 分子量: 203.238
• InChiKey: BOJLFZULDMJNNW-UHFFFAOYSA-N

物化性质

• 沸点：
  323.3±27.0 °C(Predicted)
• 密度：
  1.104±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -2.1
• 重原子数：
  14
• 可旋转键数：
  7
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.78
• 拓扑面积：
  75.6
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  2-((3-(tert-butoxy)-3-oxopropyl)amino)acetic acid 在 碳酸氢钠 、 N,N-二异丙基乙胺 作用下， 以 甲醇 、 二氯甲烷 为溶剂， 反应 18.0h， 生成 3,6,9,12-tetrakis(3-(tert-butoxy)-3-oxopropyl)-15-((3-(tert-butoxy)-3-oxopropyl)glycyl)-20,20-dimethyl-4,7,10,13,18-pentaoxo-19-oxa-3,6,9,12,15-pentaazahenicosanoic acid
  参考文献：
  名称：

  Gadolinium-binding cyclic hexapeptoids: synthesis and relaxometric properties

  摘要：

  环状六肽能够有效地结合Gd3+离子。它们的热力学稳定性已通过1H-弛豫研究进行评估。

  DOI：

  10.1039/c3ob42029a
• 作为产物：
  描述：

  3-氨基丙酸叔丁酯 在 palladium on activated charcoal sodium tetrahydroborate 、 氢气 、 magnesium sulfate 、 三乙胺 、 N,N-二异丙基乙胺 作用下， 以 甲醇 、 N,N-二甲基甲酰胺 为溶剂， -5.0~25.0 ℃ 、413.69 kPa 条件下， 反应 9.0h， 生成 2-((3-(tert-butoxy)-3-oxopropyl)amino)acetic acid
  参考文献：
  名称：

  Building Units for N-Backbone Cyclic Peptides. 3. Synthesis of Protected N^α-(ω-Aminoalkyl)amino Acids and N^α-(ω-Carboxyalkyl)amino Acids

  摘要：

  An improved synthesis of a family of amino acids that contain omega-aminoalkyl groups and of a new family containing omega-carboxyalkyl groups linked to the alpha-amine is described. The synthesis was performed by alkylation of suitably monoprotected alkylenediamines and protected omega-amino acids with triflates of alpha-hydroxy acid esters. The reaction proceeded with inversion of configuration yielding optically pure products. The N-alpha-(omega-aminoalkyl)amino acids and N-alpha-(omega-carboxyalkyl)amino acids were orthogonally protected to allow their incorporation into peptides by solid-phase peptide synthesis (SPPS) methodology.

  DOI：

  10.1021/jo961580e

文献信息

• Fullerene Unsymmetrical Bis-Adducts as Models for Novel Peptidomimetics
  作者：Dragana Milic、Maurizio Prato

  DOI：10.1002/ejoc.200900791

  日期：2010.1

  Two classes of unsymmetrical, orthogonally protected bis-fulleropyrrolidine amino acids have been prepared as models for fullerene-based peptidomimetics with the carbon sphere inserted into the peptide backbone. Two successive [3+2] cycloadditions of azomethine ylides (thermally generated from formaldehyde and the corresponding orthogonally protected glycino-amines and -acids) to C 60 afforded NHFmoc/

  已经制备了两类不对称、正交保护的双富勒吡咯烷氨基酸作为基于富勒烯的肽模拟物的模型，其中碳球插入肽主链。偶氮甲碱叶立德（由甲醛和相应的正交保护的甘氨酰胺和-酸热生成）与 C 60 的两次连续 [3+2] 环加成反应得到 NHFmoc/CO 2 tBu 和 NHBoc/CO 2 Me 富勒吡咯烷对，提供了可能在酸性和碱性条件下选择性脱保护。在两类不对称双加合物中，除 t 3 NHBoc/CO 2 Me 化合物快速分解外，所有反式 (t 1 ―t 4 ) 和赤道异构体 (e' 和 e") 的分布非常相似在色谱过程中。所有化合物均通过 UV/Vis 进行表征，
• NOVEL THIOPHENECARBOXAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF
  申请人：Yamashita Tokuyuki

  公开号：US20120101137A1

  公开（公告）日：2012-04-26

  The object of the present invention is to provide a compound having a glucokinase-activating effect. A pharmaceutical composition comprising a compound represented by the general formula (I) or a pharmaceutically acceptable salt thereof as an active ingredient: wherein X means a nitrogen atom or CR 6 , wherein R 6 means a hydrogen atom or a halogen atom; R 1 means a hydrogen atom, a C1-C6 alkyl group, a C1-C6 alkoxy group or a C1-C6 alkylthio group; R 2 means a hydrogen atom or a fluorine atom; R 3 means a hydrogen atom or a C1-C6 alkyl group; and one of R 4 and R 5 means a hydrogen atom or a C1-C6 alkyl group, and the other means a C1-C6 alkylenecarboxylic acid, a C1-C6 alkylsulfonyl group, a C1-C6 alkylcarbonyl group, or CONH 2 .

  本发明的目的是提供一种具有激活葡萄糖激酶作用的化合物。一种包含以下通式（I）所表示的化合物或其药学上可接受的盐为活性成分的药物组合物：其中X代表一个氮原子或CR6，其中R6代表氢原子或卤素原子；R1代表氢原子、C1-C6烷基、C1-C6烷氧基或C1-C6烷硫基；R2代表氢原子或氟原子；R3代表氢原子或C1-C6烷基；而R4和R5中的一个代表氢原子或C1-C6烷基，另一个代表C1-C6烷基羧酸、C1-C6烷基磺酰基、C1-C6烷基羰基或CONH2。
• pH-Responsive Fluorescence Enhancement in Graphene Oxide-Naphthalimide Nanoconjugates: A Fluorescence Turn-On Sensor for Acetylcholine
  作者：Sreejith Mangalath、Silja Abraham、Joshy Joseph

  DOI：10.1002/chem.201702198

  日期：2017.8.22

  properties were studied in detail. Synergistic effects of π–π interactions between GO and the NI chromophore, and efficient photoinduced electron‐ and energy‐transfer processes, were responsible for the strong quenching of fluorescence of these nanoconjugates, which were perturbed under acidic pH conditions, leading to significant enhancement of fluorescence emission. This nanoconjugate was successfully

  报道了一种基于氧化石墨烯-萘二甲酰亚胺（GO-NI）纳米共轭物的pH敏感型荧光“开启”传感器，用于通过监测水溶液中的乙酰胆碱酯酶（AChE）的酶活性来检测乙酰胆碱（ACh）。这些纳米共轭物是通过将1-甲基-3-（3-二甲基氨基丙基）碳二亚胺/ N共价锚定吡咯基取代的NI衍生物共价锚定在GO /还原的GO表面上而合成的研究了羟基琥珀酰亚胺的偶联策略，以及形态和光物理性质。GO和NI生色团之间π-π相互作用的协同效应，以及有效的光诱导电子和能量转移过程，导致了这些纳米共轭物的荧光强烈猝灭，这些荧光在酸性pH条件下受到干扰，从而显着增强了荧光发射。该纳米共轭物已成功用于有效检测AChE的酶促活性引起的pH变化，从而证明了其作为神经生理学范围内ACh的荧光开启传感器的实用性。
• NOVEL THIOPHENE CARBOXAMIDE DERIVATIVE AND MEDICINAL USE OF SAME
  申请人：Sanwa Kagaku Kenkyusho Co., Ltd

  公开号：EP2447265A1

  公开（公告）日：2012-05-02

  The object of the present invention is to provide a compound having a glucokinase-activating effect. A pharmaceutical composition comprising a compound represented by the general formula (I) or a pharmaceutically acceptable salt thereof as an active ingredient: wherein X means a nitrogen atom or CR6 wherein R6 means a hydrogen atom or a halogen atom; R1 means a hydrogen atom, a C1-C6 alkyl group, a C1-C6 alkoxy group or a C1-C6 alkylthio group; R2 means a hydrogen atom or a fluorine atom; R3 means a hydrogen atom or a C1-C6 alkyl group; and one of R4 and R5 means a hydrogen atom or a C1-C6 alkyl group, and the other means a C1-C6 alkylenecarboxylic acid, a C1-C6 alkylsulfonyl group, a C1-C6 alkylcarbonyl group, or CONH2.

  本发明的目的是提供一种具有葡萄糖激酶激活作用的化合物。 一种药物组合物，其活性成分包括通式（I）代表的化合物或其药学上可接受的盐： 其中 X 指氮原子或 CR6，其中 R6 指氢原子或卤素原子； R1 指氢原子、C1-C6 烷基、C1-C6 烷氧基或 C1-C6 烷硫基； R2 指氢原子或氟原子 R3 指氢原子或 C1-C6 烷基；以及 R4 和 R5 中的一个指氢原子或 C1-C6 烷基，另一个指 C1-C6 烷烯羧酸、C1-C6 烷基磺酰基、C1-C6 烷基羰基或 CONH2。
• Synthesis and Characterization of Highly Water-Soluble Dendrofulleropyrrolidine Bisadducts with DNA Binding Activity
  作者：Alejandro Montellano López、Francesco Scarel、Noelia Rubio Carrero、Ester Vázquez、Aurelio Mateo-Alonso、Tatiana Da Ros、Maurizio Prato

  DOI：10.1021/ol301946r

  日期：2012.9.7

  The synthesis, characterization and DNA binding studies of a series of polycationic fullerene adducts are reported. Thew cationic species, exhibiting reasonably high water solubility and a heterogeneous distribution of positive charges, can efficiently complex plasmid DNA. Electrophoresis studies show different DNA binding efficiencies for different adducts, some of which can be considered excellent candidates for DNA binding therapies.