2,2,2-trichloroethyl N-[(2S,4aR,6R,7R,8R,8aR)-6-fluoro-8-hydroxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl]carbamate | 260363-46-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡喃二恶英
• 英文名称: 2,2,2-trichloroethyl N-[(2S,4aR,6R,7R,8R,8aR)-6-fluoro-8-hydroxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl]carbamate
• CAS: 260363-46-0
• 化学式: C₁₆H₁₇Cl₃FNO₆
• 分子量: 444.671
• InChiKey: SVQFNKZOYRGIKP-TVQXOTEMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  27
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  86.2
• 氢给体数：
  2
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  2,2,2-trichloroethyl N-[(2S,4aR,6R,7R,8R,8aR)-6-fluoro-8-hydroxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl]carbamate 、 在 N-碘代丁二酰亚胺 、 三氟甲磺酸三甲基硅酯 、 4 A molecular sieve 作用下， 以 乙腈 为溶剂， 生成 、
  参考文献：
  名称：

  A Two-Directional and Highly Convergent Approach for the Synthesis of the Tumor-Associated Antigen Globo-H

  摘要：

  The assembly of six readily available building blocks in five glycosylation steps affords the tumor-associated Globo-H hexasaccharide 1 without the need for any intermediate protecting group manipulations. The aminopropyl spacer is employed for conjugation to carrier proteins.

  DOI：

  10.1002/(sici)1521-3773(19991203)38:23<3495::aid-anie3495>3.0.co;2-x
• 作为产物：
  描述：

  2-deoxy-2[[(2,2,2-trichloroethoxy)carbonyl]amino]-D-galactopyranose 1,3,4,6-tetraacetate 在 甲醇 、 camphor-10-sulfonic acid 、 水 、 氢溴酸 、 potassium carbonate 、 溶剂黄146 、 4,4'-二氨基二苯乙烯-2,2'-二磺酸 、 silver carbonate 作用下， 以 二氯甲烷 、 丙酮 、 乙腈 为溶剂， 生成 2,2,2-trichloroethyl N-[(2S,4aR,6R,7R,8R,8aR)-6-fluoro-8-hydroxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl]carbamate
  参考文献：
  名称：

  A Two-Directional and Highly Convergent Approach for the Synthesis of the Tumor-Associated Antigen Globo-H

  摘要：

  The assembly of six readily available building blocks in five glycosylation steps affords the tumor-associated Globo-H hexasaccharide 1 without the need for any intermediate protecting group manipulations. The aminopropyl spacer is employed for conjugation to carrier proteins.

  DOI：

  10.1002/(sici)1521-3773(19991203)38:23<3495::aid-anie3495>3.0.co;2-x

文献信息

• A Two-Directional and Highly Convergent Approach for the Synthesis of the Tumor-Associated Antigen Globo-H
  作者：Tong Zhu、Geert-Jan Boons

  DOI：10.1002/(sici)1521-3773(19991203)38:23<3495::aid-anie3495>3.0.co;2-x

  日期：——

  The assembly of six readily available building blocks in five glycosylation steps affords the tumor-associated Globo-H hexasaccharide 1 without the need for any intermediate protecting group manipulations. The aminopropyl spacer is employed for conjugation to carrier proteins.