1-O-D-glucopyranosyl-(2S,3R,9E,12E)-2-N-[(2R)-hydroxytetracosanoyl]octadecasphinga-9,12-dienine | 1068050-50-9

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 鞘脂
• 英文名称: 1-O-D-glucopyranosyl-(2S,3R,9E,12E)-2-N-[(2R)-hydroxytetracosanoyl]octadecasphinga-9,12-dienine
• 英文别名: hylodendroside-I；(2R)-2-hydroxy-N-[(2S,3R,9E,12E)-3-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadeca-9,12-dien-2-yl]tetracosanamide
• CAS: 1068050-50-9
• 化学式: C₄₈H₉₁NO₉
• 分子量: 826.252
• InChiKey: AKJFWYARNWIIBW-GNSSXDBJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  13.8
• 重原子数：
  58
• 可旋转键数：
  40
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.9
• 拓扑面积：
  169
• 氢给体数：
  7
• 氢受体数：
  9

反应信息

• 作为反应物：
  描述：

  甲醇 、 1-O-D-glucopyranosyl-(2S,3R,9E,12E)-2-N-[(2R)-hydroxytetracosanoyl]octadecasphinga-9,12-dienine 在 盐酸 作用下， 反应 12.0h， 生成 methyl (2R)-2-hydroxytetracosanoate
  参考文献：
  名称：

  A triterpenoidal saponin and sphingolipids from Pteleopsis hylodendron

  摘要：

  From the stem bark of Pteleopsis hylodendron, a triterpenoidal saponin bellericagenin {B 3-O-[beta-D-glucopyranosyl-(1 -> 2)-alpha-D-glucopyranoside] (1) (Pteleopsoside)} and two sphingolipids, hylodendroside-I (2), and hylodendroside-II (3) were isolated, along with a synthetically known compound, {2 alpha, 3 beta, 23-triacetoxy-19 alpha-hydroxyolean-12-en-28-oic acid (4)}. Other known compounds, friedelin (5), P-carotene (6), lupeol (7), sitosterol (8), and stigmasterol (9), were also obtained. Their structures were deduced with the help of detailed spectroscopic studies. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.phytochem.2008.05.006