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Acetic acid, [(1,2,3,4-tetrahydro-2,4-dioxo-1-β-D-ribofuranosyl-5-pyrimidinyl)oxy]-, methyl ester, monohydrate

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Catalog No. : NC30233

CAS No. : 54795-90-3

Product Level :

Brand : NewCan Bio

Molecular Formula : C₁₂H₁₈N₂O₁₀

Chemical Name : Acetic acid, [(1,2,3,4-tetrahydro-2,4-dioxo-1-β-D-ribofuranosyl-5-pyrimidinyl)oxy]-, methyl ester, monohydrate

Molecular Weight : 350.28

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Basic information

Standard English name
Cas No.	54795-90-3
Alias	methyl 2-((1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)oxy)acetate hydrate
Canonical Smiles	O.COC(=O)COC1=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)NC1=O
MDL No.
Exact Mass	350.09615
Smiles	O=C(OC)COC1=CN([C@H]2[C@@H]([C@@H]([C@@H](CO)O2)O)O)C(NC1=O)=O.[H]O[H]

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Inchi	InChI=1S/C12H16N2O9.H2O/c1-21-7(16)4-22-5-2-14(12(20)13-10(5)19)11-9(18)8(17)6(3-15)23-11;/h2,6,8-9,11,15,17-18H,3-4H2,1H3,(H,13,19,20);1H2/t6-,8-,9-,11-;/m1./s1
InchiKey	YFPOJQDDMGTPQA-RPWKAPHTSA-N
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