khekadaengoside D

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 类固醇和类固醇衍生物
• 英文名称: khekadaengoside D
• 英文别名: (8S,9R,10R,13R,14S,16R,17R)-16-hydroxy-4,4,9,13,14-pentamethyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-17-[(E,2R,3S)-2,3,6-trihydroxy-6-methylhept-4-en-2-yl]-8,10,12,15,16,17-hexahydro-7H-cyclopenta[a]phenanthrene-3,11-dione
• 化学式: C₃₆H₅₄O₁₂
• 分子量: 678.818
• InChiKey: MNDSHGJSXPOSMP-AEJSHFKQSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  48
• 可旋转键数：
  7
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.78
• 拓扑面积：
  214
• 氢给体数：
  8
• 氢受体数：
  12

反应信息

• 作为反应物：
  描述：

  khekadaengoside D 在 hesperidinase 作用下， 以 甲醇 、 水 为溶剂， 反应 48.0h， 生成 khekadaengenine II
  参考文献：
  名称：

  Cucurbitane, hexanorcucurbitane and octanorcucurbitane glycosides from fruits of Trichosanthes tricuspidata

  摘要：

  From the fruits of Trichosanthes tricuspidata, 14 cucurbitane glycosides (khekadaengosides A-J, M-N, cucurbitacin J 2-O-beta-glucopyranoside and cucurbitacin K 2-O-beta-glucopyranoside), a hexanorcucurbitane glucoside (khekadaengoside K) and octanorcucurbitane (khekadaengoside L) were isolated along with two known cucurbitane glucosides (cucurbitacin 2-O-beta-glucopyranoside and 25-O-acetyl-cucurbitacin 2-O-beta-glucopyranoside). Structural elucidations were based on chemical and spectroscopic analyses. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0031-9422(01)00430-7

文献信息

• Cucurbitane, hexanorcucurbitane and octanorcucurbitane glycosides from fruits of Trichosanthes tricuspidata
  作者：Tripetch Kanchanapoom、Ryoji Kasai、Kazuo Yamasaki

  DOI：10.1016/s0031-9422(01)00430-7

  日期：2002.1

  From the fruits of Trichosanthes tricuspidata, 14 cucurbitane glycosides (khekadaengosides A-J, M-N, cucurbitacin J 2-O-beta-glucopyranoside and cucurbitacin K 2-O-beta-glucopyranoside), a hexanorcucurbitane glucoside (khekadaengoside K) and octanorcucurbitane (khekadaengoside L) were isolated along with two known cucurbitane glucosides (cucurbitacin 2-O-beta-glucopyranoside and 25-O-acetyl-cucurbitacin 2-O-beta-glucopyranoside). Structural elucidations were based on chemical and spectroscopic analyses. (C) 2002 Elsevier Science Ltd. All rights reserved.