(5S,8S)-5-Isopropyl-1-methoxy-3,8-dimethyl-5,6,7,8-tetrahydro-naphthalen-2-ol | 135681-83-3

• 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: (5S,8S)-5-Isopropyl-1-methoxy-3,8-dimethyl-5,6,7,8-tetrahydro-naphthalen-2-ol
• 英文别名: (5S,8S)-1-methoxy-3,8-dimethyl-5-propan-2-yl-5,6,7,8-tetrahydronaphthalen-2-ol
• CAS: 135681-83-3
• 化学式: C₁₆H₂₄O₂
• 分子量: 248.365
• InChiKey: NBBMZJMTZIOMGM-JQWIXIFHSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.35
• 重原子数：
  18.0
• 可旋转键数：
  2.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  29.46
• 氢给体数：
  1.0
• 氢受体数：
  2.0

反应信息

• 作为产物：
  描述：

  (5S,8S)-3,8-dimethyl-5-prop-1-en-2-yl-5,6,7,8-tetrahydronaphthalene-1,2-diol 、 (5R,8S)-3,8-dimethyl-5-prop-1-en-2-yl-5,6,7,8-tetrahydronaphthalene-1,2-diol 、 碘甲烷 生成 (5S,8S)-5-Isopropyl-1-methoxy-3,8-dimethyl-5,6,7,8-tetrahydro-naphthalen-2-ol
  参考文献：
  名称：

  WAHYUONO, SUBAGUS;HOFFMANN, JOSEPH J.;BATES, ROBERT B.;MCLAUGHLIN, STEVEN+, PHYTOCHEMISTRY, 30,(1991) N, C. 2175-2182

  摘要：

  DOI：

文献信息

• Potential anti-infective o-catechol derivatives isolated from Guardiola platyphylla
  作者：Subagus Wahyuono、Joseph J. Hoffmann、Robert B. Bates、Steven P. McLaughlin

  DOI：10.1016/0031-9422(91)83609-o

  日期：1991.1

  eight potential anti-infective agents were isolated from Guardiola platyphylla. Two of these catechols obtained as a mixture were identified as (1S,4S)-7,8-dihydroxy-11,12-dehydrocalamenene and (1S,4R)-7,8-dihydroxy-11,12-dehydrocalamenene, active in vitro against Staphylococcus aureus, Bacillus subtilis, Klebsiella pneumoniae and Candida albicans at 100-mu-g ml-1. Fractions containing dimeric catechols exhibited the same activity. Due to their instability, the latter were isolated as their acetates. (1S,4S)-7,8-dihydroxy-11,12-dehydrocalamenene and (1S,4R)-7,8-dihydroxy-11,12-dehydrocalamenene were converted into dimers via oxidation to omicron-quinones and warming at 60-degrees.