2α,3β,30-trihydroxyolean-12-en-28-oic acid | 99828-62-3

• 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: 2α,3β,30-trihydroxyolean-12-en-28-oic acid
• 英文别名: (2S,4aR,6aR,6aS,6bR,8aR,10R,11R,12aR,14bS)-10,11-dihydroxy-2-(hydroxymethyl)-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
• CAS: 99828-62-3
• 化学式: C₃₀H₄₈O₅
• 分子量: 488.708
• InChiKey: BUPMKQSMMNORBY-KHQNHBDZSA-N

物化性质

• 沸点：
  606.0±55.0 °C(Predicted)
• 密度：
  1.19±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  35
• 可旋转键数：
  2
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.9
• 拓扑面积：
  98
• 氢给体数：
  4
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  2α,3β,30-trihydroxyolean-12-en-28-oic acid 在 吡啶 作用下， 以 甲醇 为溶剂， 生成 (2S,4aR,6aS,6bR,8aR,10R,11R,12aR,12bR,14bS)-10,11-Diacetoxy-2-acetoxymethyl-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydro-2H-picene-4a-carboxylic acid methyl ester
  参考文献：
  名称：

  Aquilegifolin：来自 Thalictrum aquilegifolium 的三萜糖苷

  摘要：

  摘要 从 Thalictrum aquilegiffolium 中分离出一种新的三萜糖苷 aquilegifolin，并通过化学转化、光谱分析和与密切相关化合物的比较建立了结构。

  DOI：

  10.1016/s0031-9422(00)80687-1
• 作为产物：
  描述：

  aquilegifolin 在 氢氧化钾 作用下， 反应 5.0h， 生成 2α,3β,30-trihydroxyolean-12-en-28-oic acid
  参考文献：
  名称：

  Aquilegifolin：来自 Thalictrum aquilegifolium 的三萜糖苷

  摘要：

  摘要 从 Thalictrum aquilegiffolium 中分离出一种新的三萜糖苷 aquilegifolin，并通过化学转化、光谱分析和与密切相关化合物的比较建立了结构。

  DOI：

  10.1016/s0031-9422(00)80687-1

文献信息

• ACCELERATOR FOR INITIAL INSULIN SECRETION
  申请人：Use-Techno Corporation

  公开号：EP1674089A1

  公开（公告）日：2006-06-28

  The present invention provides an early insulin secretion stimulator consisting of a triterpene represented by the following general formula (1) and/or a triterpene represented by the following general formula (2). [where R1 represents COOH, etc., R11 and R12 represent CH2OH, etc., X1 represents hydrogen or OH and X11, X12, X21 and X22 represent OH, etc.]

  本发明提供了一种早期胰岛素分泌刺激剂，由以下通式（1）代表的三萜和/或以下通式（2）代表的三萜组成。 [其中 R1 代表 COOH 等，R11 和 R12 代表 CH2OH 等，X1 代表氢或 OH，X11、X12、X21 和 X22 代表 OH 等。］
• Biotransformation of oleanolic and maslinic acids by Rhizomucor miehei
  作者：Antonio Martinez、Francisco Rivas、Alberto Perojil、Andres Parra、Andres Garcia-Granados、Antonia Fernandez-Vivas

  DOI：10.1016/j.phytochem.2013.05.011

  日期：2013.10

  Microbial transformation of oleanolic acid by Rhizomucor miehei produced three metabolites. A known compound, a 30-hydroxyl derivative (queretaroic acid), and two 7 beta,30- and 1 beta,30-dihydroxylated metabolites, respectively. The action of the same fungus (R. miehei) on maslinic acid produced an olean-11-en-28,13 beta-olide derivative, a metabolite hydroxylated at C-30, an 11-oxo derivative, and two metabolites with an 11 alpha,12 alpha-epoxy group, hydroxylated or not at C-30. Their structures were elucidated by extensive analyses of their spectroscopic data, and also by chemical correlations. (C) 2013 Elsevier Ltd. All rights reserved.
• Insulin secretion potentiator
  申请人：Matsuyama Futoshi

  公开号：US20050143464A1

  公开（公告）日：2005-06-30

  The present invention provides early insulin secretion stimulators consisting of triterpenes represented by the following general formula (1) and/or triterpenes represented by the following general formula (2). [where R 1 represents COOH, etc., R 11 and R 12 represent CH 2 OH, etc., X 1 represents hydrogen or OH and X 11 , X 12 , X 21 and X 22 represent OH, etc.]
• [EN] GLUCONEOGENESIS INHIBITING AGENT<br/>[FR] AGENTS D'INHIBITION DE LA GLUCONEOGENESE
  申请人：USE TECHNO CORP

  公开号：WO2006054370A1

  公开（公告）日：2006-05-26

  [EN] The present invention provides a gluconeogenesis inhibiting agent containing as an active ingredient corosolic acid, an analogous compound of corosolic acid, or a pharmaceutically acceptable salt thereof.
  [FR] La présente invention concerne un agent d'inhibition de la gluconéogenèse, contenant en tant qu'ingrédient actif de l'acide corosolique, un analogue de l'acide corosolique ou l'un de leurs sels pharmaceutiquement acceptables.
• Aquilegifolin: a triterpenoid glycoside from Thalictrum aquilegifolium
  作者：Hiroji Ina、Yasushi Ohta、Hideo Iida

  DOI：10.1016/s0031-9422(00)80687-1

  日期：1985.10

  Abstract A new triterpenoid glycoside, aquilegifolin, has been isolated from Thalictrum aquilegifolium and the structure established by chemical transformations, spectral analysis and comparison with closely related compounds.

  摘要 从 Thalictrum aquilegiffolium 中分离出一种新的三萜糖苷 aquilegifolin，并通过化学转化、光谱分析和与密切相关化合物的比较建立了结构。