英语词典化工词典

b-D-Glucopyranuronic acid,1-[1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-[(4aS,7aS)-octahydro-6H-pyrrolo[3,4-b]pyridin-6-yl]-4-oxo-3-quinolinecarboxylate]

b-D-Glucopyranuronic acid,1-[1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-[(4aS,7aS)-octahydro-6H-pyrrolo[3,4-b]pyridin-6-yl]-4-oxo-3-quinolinecarboxylate]


  • 中文别名:4(1H)-喹啉酮,3-氯-8-氟-6-甲氧基-
  • 中文释义:4(1H)-喹啉酮,3-氯-8-氟-6-甲氧基-;Moxifloxacin Acyl-b-D-glucuronide
  • 英文别名:Moxifloxacin Acyl-b-D-glucuronide;
    (2S,3S,4S,5R,6S)-6-(1-cyclopropyl-6-fluoro-8-Methoxy-4-oxo-7-((4aS,7aS)-tetrahydro-1H-pyrrolo[3,4-b]pyridin-6(2H,7H,7aH)-yl)-1,4-dihydroquinoline-3-carbonyloxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid;
    1-[1-Cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-[(4aS,7aS)-octahydro-6H-pyrrolo[3,4-b]pyridin-6-yl]-4-oxo-3-quinolinecarboxylate]-D-Glucopyranuronic Acid;
    Moxifloxacin Acyl--D-glucuronide;
    1-[1-Cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-[(4aS,7aS)-octahydro-6H-pyrrolo[3,4-b]pyridin-6-yl]-4-oxo-3-quinolinecarboxylate] b-D-Glucopyranuronic Aci 
  • CAS No.:733002-61-4
  • 分子式:C27H32FN3O10
  • 分子量:0
  • 精确分子量:577.20700
  • PSA:180.02000
  • 分子结构式:

物化性质

密度:
1.617g/cm3
熔点:
170-173ºC (dec.)
沸点:
864.649ºC at 760 mmHg
闪点:
476.723ºC
折射率:
1.69

安全信息

密度:
1.617g/cm3
熔点:
170-173ºC (dec.)
沸点:
864.649ºC at 760 mmHg
闪点:
476.723ºC
折射率:
1.69

分子结构与计算化学数据

计算化学数据

1.疏水参数计算参考值(XlogP):-1.5

2.氢键供体数量:5

3.氢键受体数量:14

4.可旋转化学键数量:7

5.互变异构体数量:无

6.拓扑分子极性表面积:178

7.重原子数量:41

8.表面电荷:0

9.复杂度:1090

10.同位素原子数量:0

11.确定原子立构中心数量:4

12.不确定原子立构中心数量:3

13.确定化学键立构中心数量:0

14.不确定化学键立构中心数量:0

15.共价键单元数量:1

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