(1S,2R,4R,8S)-p-menthane-2,8,9-triol 9-O-β-D-glucopyranoside | 378254-08-1

• 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: (1S,2R,4R,8S)-p-menthane-2,8,9-triol 9-O-β-D-glucopyranoside
• 英文别名: (2S)-2-Hydroxy-2-[(1R,3R,4S)-3-hydroxy-4-methylcyclohexyl]propyl I(2)-D-glucopyranoside；(2R,3R,4S,5S,6R)-2-[(2S)-2-hydroxy-2-[(1R,3R,4S)-3-hydroxy-4-methylcyclohexyl]propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
• CAS: 378254-08-1
• 化学式: C₁₆H₃₀O₈
• 分子量: 350.409
• InChiKey: KRTKKVIKRTZKGY-BJMGCPOCSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.2
• 重原子数：
  24
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  140
• 氢给体数：
  6
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  (1S,2R,4R,8S)-p-menthane-2,8,9-triol 9-O-β-D-glucopyranoside 在 hesperidinase 作用下， 以 水 为溶剂， 反应 480.0h， 以2 mg的产率得到(1S,2R,4R,8S)-p-menthane-2,8,9-triol
  参考文献：
  名称：

  New p-menthanetriols and their glucosides from the fruit of caraway

  摘要：

  Ten new p-menthanetriols, including eight stereoisomers of p-menthane-2,8,9-triol, and five new glucosides were isolated from the water-soluble portion of the methanol extract of the fruit of caraway (Carum carvi L.), which has been used as a spice and medicine. Their structures were clarified by spectral investigation. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4020(01)00776-1

文献信息

• New p-menthanetriols and their glucosides from the fruit of caraway
  作者：Tetsuko Matsumura、Toru Ishikawa、Junichi Kitajima

  DOI：10.1016/s0040-4020(01)00776-1

  日期：2001.9

  Ten new p-menthanetriols, including eight stereoisomers of p-menthane-2,8,9-triol, and five new glucosides were isolated from the water-soluble portion of the methanol extract of the fruit of caraway (Carum carvi L.), which has been used as a spice and medicine. Their structures were clarified by spectral investigation. (C) 2001 Elsevier Science Ltd. All rights reserved.