N-acetyl-4-deoxy-4-fluoro-D-glucosamine | 115973-75-6

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: N-acetyl-4-deoxy-4-fluoro-D-glucosamine
• 英文别名: N-[(2R,3R,4S,5R)-4-fluoro-3,5,6-trihydroxy-1-oxohexan-2-yl]acetamide
• CAS: 115973-75-6
• 化学式: C₈H₁₄FNO₅
• 分子量: 223.201
• InChiKey: INMTXFNTDOTKPD-LXGUWJNJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.4
• 重原子数：
  15
• 可旋转键数：
  6
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  107
• 氢给体数：
  4
• 氢受体数：
  6

文献信息

• 7-FLUORO-2, 3-DIDEHYDROSIALIC ACID AND INTERMEDIATE FOR SYNTHESIS THEREOF
  申请人：DAIKIN INDUSTRIES, LIMITED

  公开号：EP0711766A1

  公开（公告）日：1996-05-15

  2, 7-Deoxy-7-fluoro-2, 3-didehydrosialic acid of general formula (IV) and intermediates therefor of general formulae (II) and (III); in formula (II), R represents aliphatic acyl; R¹ represents lower alkyl; R²s represent each independently aliphatic or aromatic acyl; and R³ represents halogen; in formula (III), R represents aliphatic acyl; R¹ represents lower alkyl; R²s represent each independently halogen, or aliphatic or aromatic acyl; and R⁴ represents thioacyl, thioalkyl or thioaryl; each being useful for developing practical medicines such as antiviral agents and preventives for viral diseases, and also as anticancer drugs and immunoregulators.

  通式(IV)的2，7-脱氧-7-氟-2，3-二脱氢乙酸及其通式(II)和(III)的中间体；在式(II)中，R代表脂肪酰基；R¹代表低级烷基；R²s各自独立地代表脂肪酰基或芳香酰基；R³代表卤素；在式(III)中，R代表脂肪酰基；R¹代表低级烷基；R²s各自独立地代表卤素、脂肪酰基或芳香酰基；R⁴代表硫代酰基、硫代烷基或硫代芳基；它们都有助于开发实用药物，如抗病毒剂和病毒性疾病预防剂，以及抗癌药物和免疫调节剂。
• FLUORINATED GANGLIOSIDE GM3 ANALOGUES AND INTERMEDIATES THEREFOR
  申请人：DAIKIN INDUSTRIES, LIMITED

  公开号：EP0812855A1

  公开（公告）日：1997-12-17

  A novel fluorine-substituted ganglioside GM3 derivative represented by the formula (I): wherein R is an aliphatic acyl group, R1 is a hydrogen atom or a lower alkyl group, R2, R3, R4 and R6 represent independently of one another a hydrogen atom, an aliphatic lower acyl group or an aromatic acyl group, R5 is an straight or branched, saturated or unsaturated aliphatic hydrocarbon group having 1 to 30 carbon atoms, and n is an integer of 0 to 20, provided that when R1 is a hydrogen atom, R2, R3, R4 and R6 are hydrogen atoms, or when R1 is a lower alkyl group, R2, R3, R4 and R6 are each an aliphatic lower acyl group or an aromatic acyl group.

  一种由式(I)代表的新型氟取代神经节苷脂 GM3 衍生物： 其中 R 是脂肪族酰基，R1 是氢原子或低级烷基，R2、R3、R4 和 R6 相互独立地代表氢原子、脂肪族低级酰基或芳香族酰基，R5 是直链或支链具有 1 至 30 个碳原子的饱和或不饱和脂肪族烃基，n 是整数、当 R1 为氢原子时，R2、R3、R4 和 R6 为氢原子，或当 R1 为低级烷基时，R2、R3、R4 和 R6 各为脂肪族低级酰基或芳香族酰基。
• US5627290A
  申请人：——

  公开号：US5627290A

  公开（公告）日：1997-05-06
• US5789561A
  申请人：——

  公开号：US5789561A

  公开（公告）日：1998-08-04