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1-(1,1-Dimethylethyl)2-methyl(2S,4R,5R)-4-(acetyloxy)-5-(5-fluoro-3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)-1,2-pyrrolidinedicarboxylate

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Catalog No. : NC17841

CAS No. : 941576-11-0

Product Level :

Brand : NewCan Bio

Molecular Formula : C₁₇H₂₁FN₃O₈

Chemical Name : 1-(1,1-Dimethylethyl)2-methyl(2S,4R,5R)-4-(acetyloxy)-5-(5-fluoro-3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)-1,2-pyrrolidinedicarboxylate

Molecular Weight : 414.36

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Basic information

Standard English name
Cas No.	941576-11-0
Alias	(2S,4R,5R)-4-acetoxy-1-(tert-butyl)-5-(5-fluoro-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-2-methyl-1l4-pyrrolidine-1,2-dicarboxylate
Canonical Smiles	CC(C)(C)[N]1([C@H]([C@@H](C[C@@]1(C)C([O-])=O)OC(C)=O)N1C=C(F)C(=O)NC1=O)C([O-])=O
MDL No.
Exact Mass	414.13127
Smiles	O=C([N]1(C(C)(C)C)[C@@](C([O-])=O)(C)C[C@@H](OC(C)=O)[C@@H]1N(C(N2)=O)C=C(F)C2=O)[O-]

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Inchi	InChI=1S/C17H23FN3O8/c1-8(22)29-10-6-17(5,13(24)25)21(15(27)28,16(2,3)4)12(10)20-7-9(18)11(23)19-14(20)26/h7,10,12H,6H2,1-5H3,(H,24,25)(H,27,28)(H,19,23,26)/p-2/t10-,12-,17+/m1/s1
InchiKey	VWUWRCAHGUEWNR-HSOHIQCKSA-L
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