1-异硫氰酸根-9-（甲基亚磺酰基）-壬烷 | 75272-82-1

• 分子结构分类: 有机化合物 - 有机硫化合物 - 亚砜
• 中文名称: 1-异硫氰酸根-9-（甲基亚磺酰基）-壬烷
• 英文名称: 1-isothiocyanato-9-(methylsulfinyl)-nonane
• 英文别名: 1-isothiocyanato-9-methanesulfinylnonane；9-(methylsufinyl)nonyl ITC；Arabin；9-(methylsulfinyl)hexyl isothiocyanate；(R)-(9-Isothiocyanato-nonyl)-methyl-sulfoxid；(R)-9-methanesulfinyl-nonyl isothiocyanate；(R)-9-Methansulfinyl-nonylisothiocyanat；1-isothiocyanato-9-methylsulfinylnonane
• CAS: 75272-82-1
• 化学式: C₁₁H₂₁NOS₂
• 分子量: 247.426
• InChiKey: MQFLXLMNOHHPTC-UHFFFAOYSA-N

物化性质

• 沸点：
  423.1±18.0 °C(Predicted)
• 密度：
  1.06±0.1 g/cm3(Predicted)
• 溶解度：
  氯仿（少量溶解）、乙酸乙酯（少量溶解）、乙醇（少量、加热、超声处理）

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  15
• 可旋转键数：
  10
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.91
• 拓扑面积：
  80.7
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1-异硫氰酸根-9-（甲基亚磺酰基）-壬烷 在 氨 作用下， 生成 (R)-1-(9-Methylsulfinylnonyl)-thioharnstoff
  参考文献：
  名称：

  Kjaer; Gmelin, Acta Chemica Scandinavica (1947), 1956, vol. 10, p. 1358

  摘要：

  DOI：

文献信息

• [EN] FUNGICIDES TO PREVENT AND CONTROL FUNGAL PATHOGENS<br/>[FR] FONGICIDES POUR LA PRÉVENTION ET LA LUTTE CONTRE DES PATHOGÈNES FONGIQUES
  申请人：UNIV LAUSANNE

  公开号：WO2020011750A1

  公开（公告）日：2020-01-16

  The invention relates to the field of biological fungicides with a broad range of antifungal activity coming from plant extracts from the order of Brassicales or molecules revealing similar chemical structure. In particular, Applicants surprisingly provided a new usage of a combination of sulfonyl and sulfinyl containing aliphatic glucosinolates, their by-products and synthetic analogues as efficient antifungal compounds with broad spectrum of activity.

  本发明涉及一种生物杀菌剂领域，其具有来自十字花目植物提取物或具有类似化学结构的分子的广谱抗真菌活性。特别地，申请人惊奇地提供了一种新的用途，即使用含有磺酰基和亚磺酰基的脂肪族葡萄糖苷、其副产物和合成类似物的组合作为具有广谱活性的高效抗真菌化合物。
• Treatment of helicobacter with isothiocyanates
  申请人：——

  公开号：US20020151505A1

  公开（公告）日：2002-10-17

  The present invention relates to methods of preventing or inhibiting the growth of Helicobacter through the use of a composition that comprises a glucosinolate, an isothiocyanate or a derivative or metabolite thereof. The present invention also relates to methods of preventing or treating persistent chronic gastritis, ulcers and/or stomach cancer in subjects at risk for, or in need of treatment thereof.

  本发明涉及通过使用包含葡萄糖苷酸盐、异硫氰酸盐或其衍生物或代谢物的组合物来预防或抑制螺旋杆菌生长的方法。本发明还涉及预防或治疗有患病风险或需要治疗的受试者的顽固性慢性胃炎、溃疡和/或胃癌的方法。
• Treatment of helicobacter with isothocyanates
  申请人：——

  公开号：US20040180843A1

  公开（公告）日：2004-09-16

  The present invention relates to methods of preventing or inhibiting the growth of Helicobacter through the use of a composition that comprises a glucosinolate, an isothiocyanate or a derivative or metabolite thereof. The present invention also relates to methods of preventing or treating persistent chronic gastritis, ulcers and/or stomach cancer in subjects at risk for, or in need of treatment thereof.

  本发明涉及通过使用包含葡萄糖苷酸盐、异硫氰酸盐或其衍生物或代谢物的组合物来预防或抑制螺旋杆菌生长的方法。本发明还涉及预防或治疗有患病风险或需要治疗的受试者的顽固性慢性胃炎、溃疡和/或胃癌的方法。
• Compositions comprising lycopene for the treatment and prevention of angiogenesis associated pathologies
  申请人：Goralczyk Regina

  公开号：US20060020046A1

  公开（公告）日：2006-01-26

  The invention is concerned with the use of lycopene, optionally in combination with vitamin E and/or C or other biologically active ingredients as disclosed in the specification, in the manufacture of a composition for the primary and secondary prevention of angiogenesis-associated pathologies and coadjuvant treatment thereof; as well as with particular novel formulations comprising lycopene.

  本发明涉及番茄红素（可选择与维生素 E 和/或 C 或说明书中公开的其他生物活性成分结合使用）在制造用于血管生成相关病症的一级和二级预防及其辅助治疗的组合物中的用途；以及包含番茄红素的特定新型制剂。
• Method of extraction of isothiocyanates into oil from glucosinolate-containing plants and method of producing products with oil containing isothiocyanates extracted from glucosinolate-containing plants
  申请人：Fahey W. Jed

  公开号：US20060127996A1

  公开（公告）日：2006-06-15

  A method of extraction of isothiocyanates into the oil from glucosinolate-containing plants. A method of preparing products including pharmaceutical compositions, food or drink products, supplements or additives, skin or hair products, and agricultural products which contain isothiocyanate oil extracted from glucosinolate-containing plants.

  一种从含葡萄糖苷酸的植物中提取异硫氰酸酯油的方法。一种制备含有从含葡萄糖苷酸植物中提取的异硫氰酸盐油的产品的方法，这些产品包括药物组合物、食品或饮料产品、补充剂或添加剂、皮肤或头发产品以及农产品。