Nostocyclophane B | 134237-85-7

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: Nostocyclophane B
• 英文别名: (2S,3R,4S,5S,6R)-2-[[(2R,4R,8S,13R,15R,19S)-8,19-dibutyl-4,15-dichloro-21,24,26-trihydroxy-2,13-dimethoxy-10-tricyclo[18.2.2.29,12]hexacosa-1(22),9(26),10,12(25),20,23-hexaenyl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
• CAS: 134237-85-7
• 化学式: C₄₂H₆₄Cl₂O₁₁
• 分子量: 815.87
• InChiKey: QSSPVYZUPDQNSI-YUGPRRQPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.5
• 重原子数：
  55
• 可旋转键数：
  11
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  179
• 氢给体数：
  7
• 氢受体数：
  11

反应信息

• 作为反应物：
  描述：

  Nostocyclophane B 、 乙酸酐 在 吡啶 作用下， 生成 Nostocyclophane B heptaacetate
  参考文献：
  名称：

  Structures of nostocyclophanes A-D

  摘要：

  Nostocyclophanes A-D are the cytotoxins associated with the blue-green alga Nostoc linckia (Roth) Bornet ex Bornet & Flahault (UTEX B1932). The gross structures of these [7.7]paracyclophanes have been elucidated by mass and NMR spectral analyses and the relative and absolute stereochemistry of nostocyclophane D determined by X-ray crystallography. Since the CD spectra of the four compounds are essentially identical, nostocyclophanes A-D are proposed to have the same stereochemistry. The sugar unit in nostocyclophanes A and B has been shown to be D-glucose by semisynthesis of nostocyclophane B 9-O-(2,3,4,6-tetra-O-acetyl)-beta-D-glucopyranoside from nostocyclophanes B and D.

  DOI：

  10.1021/jo00014a008

文献信息

• CHEN, JIAN LU;MOORE, RICHARD E.;PATTERSON, GREGORY M. L., J. ORG. CHEM., 56,(1991) N4, C. 4360-4364
  作者：CHEN, JIAN LU、MOORE, RICHARD E.、PATTERSON, GREGORY M. L.

  DOI：——

  日期：——