(3R)-3,7-dimethyl-6-octenal thiosemicarbazone

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: (3R)-3,7-dimethyl-6-octenal thiosemicarbazone
• 英文别名: (3R)-(+)-citronellal thiosemicarbazone；[(Z)-[(3R)-3,7-dimethyloct-6-enylidene]amino]thiourea
• 化学式: C₁₁H₂₁N₃S
• 分子量: 227.374
• InChiKey: QXHXPVGZJVKQTH-GARZTLJTSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  15
• 可旋转键数：
  6
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.64
• 拓扑面积：
  82.5
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  (+)-香茅醛 、 氨基硫脲 以 乙醇 为溶剂， 反应 1.0h， 以95%的产率得到(3R)-3,7-dimethyl-6-octenal thiosemicarbazone
  参考文献：
  名称：

  Synthesis, spectroscopic characterization and biological properties of new natural aldehydes thiosemicarbazones

  摘要：

  As part of a research programme aimed at the synthesis of compounds with antiviral antibacterial and antitumor properties and their spectroscopic characterization, new thiosemicarbazones deriving from natural aldehydes have been investigated. These substances contain in the same molecule both a chain with nucleophilic centres N, S with tubercolostatic activity, and a glycosidic or alkyl moiety (modified glycosides and nucleosides have recently received a great deal of attention in the fields of neoplastic diseases and viral infections). In this paper the synthesis and the characterization of these compounds by means of H-1 NMR, IR, and MS techniques is reported. Biological studies have involved both inhibition of cell proliferation and apoptosis rests on human leukemia cell line U937, (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0968-0896(99)00260-6

文献信息

• Synthesis, spectroscopic characterization and biological properties of new natural aldehydes thiosemicarbazones
  作者：Pieralberto Tarasconi、Silvia Capacchi、Giorgio Pelosi、Mara Cornia、Roberto Albertini、Antonio Bonati、Pier Paolo Dall'Aglio、Paolo Lunghi、Silvana Pinelli

  DOI：10.1016/s0968-0896(99)00260-6

  日期：2000.1

  As part of a research programme aimed at the synthesis of compounds with antiviral antibacterial and antitumor properties and their spectroscopic characterization, new thiosemicarbazones deriving from natural aldehydes have been investigated. These substances contain in the same molecule both a chain with nucleophilic centres N, S with tubercolostatic activity, and a glycosidic or alkyl moiety (modified glycosides and nucleosides have recently received a great deal of attention in the fields of neoplastic diseases and viral infections). In this paper the synthesis and the characterization of these compounds by means of H-1 NMR, IR, and MS techniques is reported. Biological studies have involved both inhibition of cell proliferation and apoptosis rests on human leukemia cell line U937, (C) 2000 Elsevier Science Ltd. All rights reserved.