hyrtioreticulin E | 42438-96-0

• 分子结构分类: 有机化合物 - 生物碱及其衍生物 - 哈马拉生物碱
• 英文名称: hyrtioreticulin E
• 英文别名: (1R,3S)-6-hydroxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
• CAS: 42438-96-0
• 化学式: C₁₃H₁₄N₂O₃
• 分子量: 246.266
• InChiKey: WYQWRMWMBQUYSD-KBUNVGBDSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.1
• 重原子数：
  18
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  85.4
• 氢给体数：
  4
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  三氟乙酸 、 hyrtioreticulin E 以 甲醇 为溶剂， 生成
  参考文献：
  名称：

  Concise Syntheses of Hyrtioreticulins C and D via a C-4 Pictet–Spengler Reaction: Revised Signs of Specific Rotations

  摘要：

  The first syntheses of hyrtioreticulins C and D via a Pictet Spengler reaction at the C-4 position of the indole rings are described. The synthesis proceeds in only two steps from commercially available starting materials. In this Communication, the structures of the natural products were confirmed. Furthermore, we revise the signs of the specific rotations of hyrtioreticulins C and D.

  DOI：

  10.1021/acs.jnatprod.7b00008
• 作为产物：
  描述：

  2-氨基-3-(5-羟基-1H-吲哚-3-基)丙酸甲酯 在 水 、 溶剂黄146 、 sodium hydroxide 作用下， 以 甲醇 为溶剂， 反应 2.0h， 生成 hyrtioreticulin E
  参考文献：
  名称：

  Concise Syntheses of Hyrtioreticulins C and D via a C-4 Pictet–Spengler Reaction: Revised Signs of Specific Rotations

  摘要：

  The first syntheses of hyrtioreticulins C and D via a Pictet Spengler reaction at the C-4 position of the indole rings are described. The synthesis proceeds in only two steps from commercially available starting materials. In this Communication, the structures of the natural products were confirmed. Furthermore, we revise the signs of the specific rotations of hyrtioreticulins C and D.

  DOI：

  10.1021/acs.jnatprod.7b00008

文献信息

• Concise Syntheses of Hyrtioreticulins C and D via a C-4 Pictet–Spengler Reaction: Revised Signs of Specific Rotations
  作者：Takumi Abe、Koji Yamada

  DOI：10.1021/acs.jnatprod.7b00008

  日期：2017.2.24

  The first syntheses of hyrtioreticulins C and D via a Pictet Spengler reaction at the C-4 position of the indole rings are described. The synthesis proceeds in only two steps from commercially available starting materials. In this Communication, the structures of the natural products were confirmed. Furthermore, we revise the signs of the specific rotations of hyrtioreticulins C and D.