Name: Sofosbuvir impurity F
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214315016
Cas No:1337482-17-3
常用名:Sofosbuvir impurity F
别名:索非布韦杂质 F, Sofosbuvir 3',5'-Bis-(S)-phosphate
别名:索非布韦杂质 F, Sofosbuvir 3',5'-Bis-(S)-phosphate
IUPAC:propan-2-yl (2S)-2-[({[(2R,3R,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-4-fluoro-4-methyl-2-{[({[(2S)-1-oxo-1-(propan-2-yloxy)propan-2-yl]amino}(phenoxy)phosphoryl)oxy]methyl}oxolan-3-yl]oxy}(phenoxy)phosphoryl)amino]propanoate
IUPAC:propan-2-yl (2S)-2-[({[(2R,3R,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-4-fluoro-4-methyl-2-{[({[(2S)-1-oxo-1-(propan-2-yloxy)propan-2-yl]amino}(phenoxy)phosphoryl)oxy]methyl}oxolan-3-yl]oxy}(phenoxy)phosphoryl)amino]propanoate
InChI key:WVORGVRHMQFKTN-ACVYKXDBSA-N

分子式:C34H45FN4O13P2
分子量:798.695
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]1(O[C@H](COP(=O)(N[C@@H](C)C(=O)OC(C)C)Oc2ccccc2)[C@@H](OP(=O)(N[C@@H](C)C(=O)OC(C)C)Oc2ccccc2)[C@@]1(C)F)n1ccc(=O)[nH]c1=O
SMILES:[H][C@]1(O[C@H](COP(=O)(N[C@@H](C)C(=O)OC(C)C)Oc2ccccc2)[C@@H](OP(=O)(N[C@@H](C)C(=O)OC(C)C)Oc2ccccc2)[C@@]1(C)F)n1ccc(=O)[nH]c1=O

Sofosbuvir impurity F (Sofosbuvir 3',5'-Bis-(S)-phosphate) 既是 Sofosbuvir 的非对映异构体，也是 Sofosbuvir 的杂质，Sofosbuvir 是 HCV RNA 复制的抑制剂。

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