(m-nitrobenzoyl)alanine | 117958-15-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: (m-nitrobenzoyl)alanine
• 英文别名: (2S)-2-[(3-nitrobenzoyl)amino]propanoic acid
• CAS: 117958-15-3
• 化学式: C₁₀H₁₀N₂O₅
• mdl: MFCD08485081
• 分子量: 238.2
• InChiKey: CDBXKLYOJGRINM-LURJTMIESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  112
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  乙醇 、 (m-nitrobenzoyl)alanine 在 盐酸 作用下， 生成 N-(3-nitro-benzoyl)-L-alanine ethyl ester
  参考文献：
  名称：

  High-resolution quantitative imaging of plagioclase composition using accumulated backscattered electron images: new constraints on oscillatory zoning

  摘要：

  Oscillatory zoning in plagioclase is investigated at small scale (less than or equal to10 mum) using accumulated backscattered electron (BSE) images as high-resolution imaging method. Combined with electron microprobe quantitative analysis. gray-value profiles across these images can be calibrated for An-content with a resolution of 0.5 mol% An. Applied to oscillatory-zoned crystals. this new application of BSE imaging allows better characterization of zoning patterns along a profile and quantification of wavelength. amplitude, and shape of the oscillations. We also obtain high-resolution information on the morphology of growth zones boundaries. This approach allows us to better classify the different types of "oscillations" and concentric zoning. Dissolution is more frequent than usually recognized. Major resorption surfaces crosscut several growth zones. Irregular 5-10-mum saw-tooth zones are delimited by faint wavy dissolution surfaces and must be distinguished from small-scale oscillations (less than or equal to1-3 pm) with straight boundaries. This suggests at least two mechanisms for the formation of these zoning patterns: faint oscillations are probably caused by local kinetic control whereas wavy dissolution surfaces involve magma chamber dynamics.

  DOI：

  10.1007/s004100100298
• 作为产物：
  描述：

  N-(3-硝基苯甲酰基)-DL-丙氨酸 生成 (m-nitrobenzoyl)alanine
  参考文献：
  名称：

  High-resolution quantitative imaging of plagioclase composition using accumulated backscattered electron images: new constraints on oscillatory zoning

  摘要：

  Oscillatory zoning in plagioclase is investigated at small scale (less than or equal to10 mum) using accumulated backscattered electron (BSE) images as high-resolution imaging method. Combined with electron microprobe quantitative analysis. gray-value profiles across these images can be calibrated for An-content with a resolution of 0.5 mol% An. Applied to oscillatory-zoned crystals. this new application of BSE imaging allows better characterization of zoning patterns along a profile and quantification of wavelength. amplitude, and shape of the oscillations. We also obtain high-resolution information on the morphology of growth zones boundaries. This approach allows us to better classify the different types of "oscillations" and concentric zoning. Dissolution is more frequent than usually recognized. Major resorption surfaces crosscut several growth zones. Irregular 5-10-mum saw-tooth zones are delimited by faint wavy dissolution surfaces and must be distinguished from small-scale oscillations (less than or equal to1-3 pm) with straight boundaries. This suggests at least two mechanisms for the formation of these zoning patterns: faint oscillations are probably caused by local kinetic control whereas wavy dissolution surfaces involve magma chamber dynamics.

  DOI：

  10.1007/s004100100298

文献信息

• [EN] KYNURENINE 3-MONOOXYGENASE (KMO) INHIBITORS, AND USES AND COMPOSITIONS THEREOF<br/>[FR] INHIBITEURS DE LA KYNURÉNINE 3-MONOOXYGÉNASE (KMO), ET UTILISATIONS ET COMPOSITIONS ASSOCIÉES
  申请人：UNIV LEICESTER

  公开号：WO2019102186A1

  公开（公告）日：2019-05-31

  There is provided compounds of formula (I) or pharmaceutically-acceptable salts thereof, wherein: L, X, R1, R2 and n have meanings provided in the description, which compounds are useful in the treatment of neurodegenerative and neuroinflammatory diseases.

  提供了具有以下结构式（I）或其药用盐的化合物，其中：L、X、R1、R2和n的含义如描述中所提供的，这些化合物在治疗神经退行性和神经炎症性疾病方面是有用的。
• N-(4-Aryl-thiazol-2-yl)-sulfonamide und deren Verwendung
  申请人：F. HOFFMANN-LA ROCHE AG

  公开号：EP0819681A2

  公开（公告）日：1998-01-21

  Die Erfindung betrifft die Verwendung von Sulfonamid-Derivaten der allgemeinen Formel    worin Rnieder-Alkyl, Phenyl, Benzyl, Naphthyl, Pyridyl oder Thienyl, gegebenenfalls einfach oder mehrfach substituiert durch nieder-Alkyl, nieder-Alkoxy, nieder-Alkyl-carbonyl-amino, Halogen, Cycloalkyl, Nitro, Amino, Methylendioxy, Phenoxy oder Benzyloxy, wobei die aromatischen Ringe wiederum durch Nitro, Halogen oder Amino substituiert sein können, R1-R4Wasserstoff, Halogen, Hydroxy, nieder-Alkyl, Nitro, Cyano, Amino, nieder-Alkoxy, Benzyloxy, Trifluormethyl oder Phenyl, gegebenenfalls einfach oder mehrfach substituiert durch nieder-Alkyl, Trifluormethyl, Nitro, Amino oder Hydroxy, und wobei R1 und R2 oder R2 und R3 zusammen einen Benzolring bilden können, der gegebenenfalls substituiert sein kann durch Halogen, Trifluormethyl, Nitro, nieder-Alkyl oder nieder-Alkoxy, bedeuten, sowie von deren pharmazeutisch annehmbare Salze als Kynurenin-3-Hydroxylase Hemmstoffe bei der Bekämpfung oder Verhütung von neurodegenerativen Erkrankungen, neurologischen Erkrankungen als Folge einer Aktivierung des Immunsystems, von psychiatrischen Leiden bzw. zur Herstellung entsprechender Arzneimittel.

  本发明涉及通式如下的磺酰胺衍生物的用途 其中 Ris 低级烷基、苯基、苄基、萘基、吡啶基或噻吩基，可任选被低级烷基、低级烷氧基、低级烷基-羰基-氨基、卤素、环烷基、硝基、氨基、亚甲基二氧基、苯氧基或苄氧基单取代或多取代，其中芳环可依次被硝基、卤素或氨基取代、 R1-R4为氢、卤素、羟基、低级烷基、硝基、氰基、氨基、低级烷氧基、苄氧基、三氟甲基或苯基，可选择被低级烷基、三氟甲基、硝基、氨基或羟基单取代或多取代、 其中 R1 和 R2 或 R2 和 R3 可共同形成一个苯环，该苯环可任选被卤素、三氟甲基、硝基、低级烷基或低级烷氧基取代，其药学上可接受的盐类可作为犬尿氨酸-3-羟化酶抑制剂，用于控制或预防神经退行性疾病、免疫系统激活导致的神经系统疾病、精神疾病或制备相应的药物。
• Treatment of aneurysms
  申请人：Georgia State University Research Foundation, Inc.

  公开号：US11376248B2

  公开（公告）日：2022-07-05

  The present invention provides methods for detecting and/or treating a subject having an aneurysm or at risk for developing an aneurysm. It has been discovered that a key metabolite of the kynurenine (Kyn) pathway, a major route for the metabolism of essential amino acid tryptophan (Trp) into nicotinamide adenine dinucleotide (NAD+), plays a critical role in the formation of aneurysms, for example abdominal aortic aneurysms. In particular, it has been discovered that 3-Hydroxyanthranilic acid (3-HAA), a product of kynureninase (KYNU), plays a causative role in the formation of aneurysms by, for example exerting pro-inflammatory effects on vascular smooth muscle cells. It has further been discovered that elevated levels of 3-HAA are indicative of the presence and/or progression of an aneurysm, and 3-HAA levels correlate with the size (aortic diameter) of the aneurysm.

  本发明提供了检测和/或治疗患有动脉瘤或有罹患动脉瘤风险的受试者的方法。现已发现，犬尿氨酸（Kyn）途径的一种关键代谢物--将必需氨基酸色氨酸（Trp）代谢为烟酰胺腺嘌呤二核苷酸（NAD+）的主要途径--在动脉瘤（例如腹主动脉瘤）的形成中起着关键作用。特别是，研究发现，3-羟基氨基苯甲酸（3-HAA）是犬尿苷酶（KYNU）的产物，通过对血管平滑肌细胞产生促炎作用等方式，在动脉瘤的形成过程中起着致病作用。研究进一步发现，3-HAA 水平的升高表明动脉瘤的存在和/或发展，3-HAA 水平与动脉瘤的大小（主动脉直径）相关。
• KYNURENINE 3-MONOOXYGENASE (KMO) INHIBITORS, AND USES AND COMPOSITIONS THEREOF
  申请人：University of Leicester

  公开号：EP3713935A1

  公开（公告）日：2020-09-30
• Methods and Compositions for the Treatment of Alcoholism and Alcohol Dependence
  申请人：Badawy Abdulla Abu-Bakr

  公开号：US20080076796A1

  公开（公告）日：2008-03-27

  Use is disclosed of (a) an AlDH-inhibitory amount of a Trp metabolite, or an analogue or derivative thereof or (b) a bioprecursor thereof, or (c) a potentiator of (a) and/or (b), in the preparation of a medicament for treating alcoholism and/or alcohol dependence.