| 1030360-73-6

• 分子结构分类: 有机化合物 - 有机氧化合物
• CAS: 1030360-73-6
• 化学式: C₃₂H₅₂N₆O₁₉
• 分子量: 824.794
• InChiKey: OAZNNPLHAKICOD-NWVLWDOASA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -5.65
• 重原子数：
  57.0
• 可旋转键数：
  20.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.81
• 拓扑面积：
  390.58
• 氢给体数：
  12.0
• 氢受体数：
  19.0

反应信息

• 作为反应物：
  描述：

  在 水 、 三苯基膦 作用下， 以 四氢呋喃 、 甲醇 为溶剂， 反应 16.0h， 生成
  参考文献：
  名称：

  Sialoside Analogue Arrays for Rapid Identification of High Affinity Siglec Ligands

  摘要：

  The siglec family of sialic acid binding proteins participates in diverse I cell surface biology that includes regulation of immune cell signaling and the interaction of neuronal cells with glial cells. The weak intrinsic affinity of the natural sialoside ligands has hampered the development of synthetic ligand based probes needed to elucidate their roles in siglec function. In this report, we describe a glycan microarray comprising a library of 9-acyl-substituted sialic acids incorporated into sialosides containing the Neu5Aca2-3Gal and Neu5Aca2-6Gal linkages commonly recognized by the siglecs. The array is demonstrated to exhibit utility for detecting 9-acyl substituents that increase the affinity of siglecs for their ligands. Substituents that increase affinity are anticipated to be useful for the design of high affinity ligand based probes of siglec function.

  DOI：

  10.1021/ja801052g
• 作为产物：
  描述：

  N-(2-(((2R,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)ethyl)pent-4-enamide 、 cytidine 5’-monophosphate-5-acetamido-9-azido-3,5,9-trideoxy-D-glycero-D-galacto-nonulosonic acid 在 Tris-HCl buffer 、 manganese(ll) chloride 作用下， 反应 14.0h， 生成
  参考文献：
  名称：

  Sialoside Analogue Arrays for Rapid Identification of High Affinity Siglec Ligands

  摘要：

  The siglec family of sialic acid binding proteins participates in diverse I cell surface biology that includes regulation of immune cell signaling and the interaction of neuronal cells with glial cells. The weak intrinsic affinity of the natural sialoside ligands has hampered the development of synthetic ligand based probes needed to elucidate their roles in siglec function. In this report, we describe a glycan microarray comprising a library of 9-acyl-substituted sialic acids incorporated into sialosides containing the Neu5Aca2-3Gal and Neu5Aca2-6Gal linkages commonly recognized by the siglecs. The array is demonstrated to exhibit utility for detecting 9-acyl substituents that increase the affinity of siglecs for their ligands. Substituents that increase affinity are anticipated to be useful for the design of high affinity ligand based probes of siglec function.

  DOI：

  10.1021/ja801052g