(5Ξ,6S)-6r-isopropyl-9t-methyl-1,3-diaza-spiro[4.5]decane-2,4-dione | 17138-09-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑烷类
• 英文名称: (5Ξ,6S)-6r-isopropyl-9t-methyl-1,3-diaza-spiro[4.5]decane-2,4-dione
• 英文别名: (5Ξ,6S)-6r-Isopropyl-9t-methyl-1,3-diaza-spiro[4.5]decan-2,4-dion；(6S,9R)-9-methyl-6-propan-2-yl-1,3-diazaspiro[4.5]decane-2,4-dione
• CAS: 17138-09-9；17138-11-3；52153-45-4；83377-81-5
• 化学式: C₁₂H₂₀N₂O₂
• 分子量: 224.303
• InChiKey: JFIJBPZIPDYERJ-RLBMWQAVSA-N

物化性质

• 密度：
  1.11±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  16
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  58.2
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  (-)-薄荷酮 、 氰化钾 在 碳酸氢铵 作用下， 生成 (5Ξ,6S)-6r-isopropyl-9t-methyl-1,3-diaza-spiro[4.5]decane-2,4-dione
  参考文献：
  名称：

  Hydantoins from Alicyclic Ketones and Aldehydes

  摘要：

  DOI：

  10.1021/ja01630a030

文献信息

• Direct chemical derivatization of natural plant extract: straightforward synthesis of natural plant-like hydantoin
  作者：Keisuke Tomohara、Tomohiro Ito、Naoto Hasegawa、Atsushi Kato、Isao Adachi

  DOI：10.1016/j.tetlet.2016.01.054

  日期：2016.2

  The direct chemical derivatization of natural plant extracts that would enable the straightforward synthesis of natural plant-like molecules seemed to be far from reality due primarily to the inherently complex chemical property of the extract. After model studies, the envisioned derivatization was realized under the rationally designed Bucherer–Bergs reaction conditions to afford unnatural hydantoin

  天然植物提取物的直接化学衍生化将使天然植物样分子的直接合成成为现实，这似乎还远远没有实现，这主要是由于提取物固有的复杂化学性质。经过模型研究，可以在合理设计的Bucherer-Bergs反应条件下实现预想的衍生化反应，以从姜黄姜黄乙酸乙酯提取物中提供带有四取代碳的非天然乙内酰脲。反应以足够的化学选择性进行，从而通过可靠的光谱分析指导从混合物中鉴定出所需的产物。
• Cyclopeptide, pharmaceutical or cosmetic composition comprising the same and method for preparing the same
  申请人：National Tsing Hua University

  公开号：US20180298060A1

  公开（公告）日：2018-10-18

  A cyclopeptide is disclosed, which is represented by the following formula (I) or (I′): wherein R 1 is defined in the specification. In addition, a pharmaceutical or cosmetic composition comprising the same and a method for preparing the same are also disclosed.

  本发明揭示了一种环肽，其由以下式子(I)或(I')表示：其中R1在规范中有定义。此外，还揭示了包含该环肽的药物或化妆品组合物以及制备该组合物的方法。
• METHOD FOR PREPARING A CYCLOPEPTIDE
  申请人：National Tsing Hua University

  公开号：EP3628677A1

  公开（公告）日：2020-04-01

  A cyclopeptide is disclosed, which is represented by the following formula (I) or (I'): wherein R1 and G' are defined in the specification. In addition, a pharmaceutical or cosmetic composition comprising the same and a method for preparing the same are also disclosed.

  本发明公开了一种环肽，它由下式（I）或（I'）表示： 其中 R1 和 G' 在说明书中定义。此外，还公开了包含该环肽的药物或化妆品组合物及其制备方法。
• Method for preparing cyclopeptide
  申请人：National Tsing Hua University

  公开号：US10851134B2

  公开（公告）日：2020-12-01

  A method for preparing a cyclopeptide, which includes the following steps: (A) providing compounds represented by the following formulas (II-1) or (II′-1) and (II-2); (B) performing a reaction between the compounds of formulas (II-1) or (II′-1) and (II-2), to obtain a compound represented by the following formula (II-3) and (II′-3), respectively; (C) performing a reaction between the compound of formula (II-3) or (II′-3) and a compound represented by the following formula (II-4) or (II′-4), respectively, is performed, to obtain a compound represented by the following formula (II-5), and (II′-5), respectively; (D) performing a cyclization reaction of the compound of formula (II-5) or (II′-5) with a catalyst of formula (III), to obtain a compound represented by the following formula (I) or (I′), respectively. The formulas (I), (I′), (II-1) to (II-5), (II′-1) to (II′-5) and (III) are shown in the specification.

  一种制备环肽的方法，它包括下列步骤：(A)提供下式(Ⅱ-1)或(Ⅱ′-1)和(Ⅱ-2)所代表的化合物；(B)在式(Ⅱ-1)或(Ⅱ′-1)和(Ⅱ-2)的化合物之间进行反应，分别得到下式(Ⅱ-3)和(Ⅱ′-3)所代表的化合物；(C)将式(Ⅱ-3)或(Ⅱ′-3)化合物分别与下式(Ⅱ-4)或(Ⅱ′-4)代表的化合物进行反应，分别得到下式(Ⅱ-5)和(Ⅱ′-5)代表的化合物；(D)用式(III)催化剂对式(II-5)或(II′-5)化合物进行环化反应，分别得到下式(I)或(I′)代表的化合物。式(Ⅰ)、(Ⅰ′)、(Ⅱ-1)至(Ⅱ-5)、(Ⅱ′-1)至(Ⅱ′-5)和(Ⅲ)如说明书所示。
• N-MENTHYL-SUBSTITUTED AMIDES
  作者：ALLAN R. DAY、CHARLES F. KELLY

  DOI：10.1021/jo01214a001

  日期：1939.1