N-[2-(4-hydroxyphenyl)ethyl]hexanamide | 1184818-23-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: N-[2-(4-hydroxyphenyl)ethyl]hexanamide
• 英文别名: N-Caproyl tyramine
• CAS: 1184818-23-2
• 化学式: C₁₄H₂₁NO₂
• mdl: MFCD12907228
• 分子量: 235.326
• InChiKey: OOAYUBIIDJANMN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  17
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  49.3
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  对羟基苯乙胺 、 [(2R,3R,4R,5R)-5-(6-氨基嘌呤-9-基)-2-[[[[3-[2-(2-己酰硫基乙基氨基甲酰)乙基氨基甲酰]-3-羟基-2,2-二甲基-丙氧基]-羟基-磷酰]氧基-羟基-磷酰]氧基甲基]-4-羟基-四氢呋喃-3-基]氧基膦酸 在 5,5'-二硫双(2-硝基苯甲酸) 、 Drosophila melanogaster arylalkylamine N-acetyltransferase A from E_. coli 作用下， 以 aq. buffer 为溶剂， 生成 N-[2-(4-hydroxyphenyl)ethyl]hexanamide
  参考文献：
  名称：

  Mechanistic and Structural Analysis of Drosophila melanogaster Arylalkylamine N-Acetyltransferases

  摘要：

  Arylalkylamine N-acetyltransferase (AANAT) catalyzes the penultimate step in the biosynthesis of melatonin and other N-acetylarylalkylamides from the corresponding arylalkylamine and acetyl-CoA. The N-acetylation of arylalkylamines is a critical step in Drosophila melanogaster for the inactivation of the bioactive amines and the sclerotization of the cuticle. Two AANAT variants (AANATA and AANATB) have been identified in D. melanogaster, in which AANATA differs from AANATB by the truncation of 35 amino acids from the N-terminus. We have expressed and purified both D. melanogaster AANAT variants (AANATA and AANATB) in Escherichia coli and used the purified enzymes to demonstrate that this N-terminal truncation does not affect the activity of the enzyme. Subsequent characterization of the kinetic and chemical mechanism of AANATA identified an ordered sequential mechanism, with acetyl-CoA binding first, followed by tyramine. We used a combination of pH-activity profiling and site-directed mutagenesis to study prospective residues believed to function in AANATA catalysis. These data led to an assignment of Glu-47 as the general base in catalysis with an apparent pKa of 7.0. Using the data generated for the kinetic mechanism, structure-function relationships, pH-rate profiles, and site-directed mutagenesis, we propose a chemical mechanism for AANATA.

  DOI：

  10.1021/bi5006078

文献信息

• Methods and Compositions for Pest Control
  申请人：Jones Tappey H.

  公开号：US20130289125A1

  公开（公告）日：2013-10-31

  Methods and compositions for pest control, and more particularly for control of ants, e.g., of the subfamily Myrmicinae, using tyramides.

  使用酪胺酸衍生物的方法和组合物，尤其是用于控制蚂蚁，例如亚科Myrmicinae的控制。
• US3957905A
  申请人：——

  公开号：US3957905A

  公开（公告）日：1976-05-18
• US4013618A
  申请人：——

  公开号：US4013618A

  公开（公告）日：1977-03-22
• US9950994B2
  申请人：——

  公开号：US9950994B2

  公开（公告）日：2018-04-24
• [EN] Methods and Compositions for Pest Control<br/>[FR] PROCÉDÉS ET COMPOSITIONS POUR LA LUTTE CONTRE LES NUISIBLES
  申请人：VMI FOUNDATION

  公开号：WO2012061624A2

  公开（公告）日：2012-05-10

  Methods and compositions for pest control, and more particularly for control of ants, e.g., of the subfamily Myrmicinae, using tyramides.