(+)-aristol-9-ene | 27862-07-3

• 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: (+)-aristol-9-ene
• 英文别名: α-Ferulen；alpha-Ferulene；(1aS,7S,7aS,7bR)-1,1,7,7a-tetramethyl-2,4,5,6,7,7b-hexahydro-1aH-cyclopropa[a]naphthalene
• CAS: 27862-07-3
• 化学式: C₁₅H₂₄
• 分子量: 204.356
• InChiKey: FOBXOZMHEKILEY-MUYACECFSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  15
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.87
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为反应物：
  描述：

  (+)-aristol-9-ene 在 palladium on activated charcoal 氢气 作用下， 生成 Ferulen
  参考文献：
  名称：

  Sesquiterpene constituents from the liverwort Bazzania japonica

  摘要：

  The hydrodistillation products of the liverwort Bazzania japonica were separated by preparative gas chromatography (GC) and investigated by spectroscopic methods. Seven unknown compounds were isolated and identified by GC-MS and NMR. Four of them, the norsesquiterpene hydrocarbons 4-epi-11-nor-aristola-1(10), 11-diene (1), 4-epi-11-nor-aristola-1,9,11-triene (2), 4-epi-11-nor-aristola-9. 11-diene (3), and one oxygenated sesquiterpene, (-)-aristol-1(10)-en-12-ol (5) are new natural compounds, and one, (+)-himachala-2.4-diene (7). has for the first time been isolated from liverworts. The absolute configurations of 5 and 7 were derived by chemical correlation reactions and/or enantioselective GC using cyclodextrin phases. 1, 2 and 3 have identical absolute configuration. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0031-9422(03)00188-2
• 作为产物：
  描述：

  (4R,5S,6R,7S)-aristol-9-en-3-one 在 sodium tetrahydroborate 作用下， 以 甲醇 、 溶剂黄146 为溶剂， 反应 15.0h， 生成 (+)-aristol-9-ene
  参考文献：
  名称：

  Bowden, Bruce F.; Coll, John C.; Mitchell, Sarah Jane, Australian Journal of Chemistry, 1980, vol. 33, # 3, p. 681 - 684

  摘要：

  DOI：