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CAS 136891-16-2

(5-oxo-1,3-oxathiolan-2-yl)methyl butyrate

Codes:EMTR-005

Application context (from source-drug indications)

HIV感染比克恩丙诺乙型肝炎比克恩丙诺HIV感染恩曲他滨/富马酸磷丙替诺福韦获得性免疫缺损综合征恩曲他滨/富马酸磷丙替诺福韦进行性多病灶脑白质病恩曲他滨/富马酸磷丙替诺福韦HIV感染恩曲他滨/盐酸利匹韦林/富马酸替诺福韦二吡呋酯

Source drugs (routes using this intermediate)

DrugTierExpiry
比克恩丙诺Bictegravir/Emtricitabine/Tenofovir Alafenamide FumarateTier B — Position early-
恩曲他滨/富马酸磷丙替诺福韦Emtricitabine/Tenofovir Alafenamide FumarateTier B — Position early-
恩曲他滨/盐酸利匹韦林/富马酸替诺福韦二吡呋酯Emtricitabine/Rilpivirine Hydrochloride/Tenofovir Disoproxil FumarateTier B — Position early-

Position in synthesis routes (up/downstream chain)

Ordered by route registration; left → right is the synthesis direction. The highlighted node is the current CAS; others link to their own profiles.

比克恩丙诺原研路线steps: 7total yield: 33 mg
(Z)-but-2-ene-1,4-diol→(Z)-but-2-ene-1,4-diyl dibutyrate→2-oxoethyl butyrate→2-mercaptoacetic acid→(5-oxo-1,3-oxathiolan-2-yl)methyl butyrate→(5-acetoxy-1,3-oxathiolan-2-yl)methyl butyrate→5-fluoro-N-(trimethylsilyl)-2-((trimethylsilyl)oxy)pyrimidin-4-amine→(5-(4-amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl butyrate→((2R,5S)-5-(4-amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl butyrate
恩曲他滨/富马酸磷丙替诺福韦原研路线steps: 7total yield: 33 mg
(Z)-but-2-ene-1,4-diol→(Z)-but-2-ene-1,4-diyl dibutyrate→2-oxoethyl butyrate→2-mercaptoacetic acid→(5-oxo-1,3-oxathiolan-2-yl)methyl butyrate→(5-acetoxy-1,3-oxathiolan-2-yl)methyl butyrate→5-fluoro-N-(trimethylsilyl)-2-((trimethylsilyl)oxy)pyrimidin-4-amine→(5-(4-amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl butyrate→((2R,5S)-5-(4-amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl butyrate
(Z)-but-2-ene-1,4-diol→(Z)-but-2-ene-1,4-diyl dibutyrate→2-oxoethyl butyrate→2-mercaptoacetic acid→(5-oxo-1,3-oxathiolan-2-yl)methyl butyrate→(5-acetoxy-1,3-oxathiolan-2-yl)methyl butyrate→5-fluoro-N-(trimethylsilyl)-2-((trimethylsilyl)oxy)pyrimidin-4-amine→(5-(4-amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl butyrate→((2R,5S)-5-(4-amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl butyrate

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