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122567-97-9

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122567-97-9 Structure

122567-97-9 Structure
IdentificationBack Directory
[Name]

[(2S,5R)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl benzoate
[CAS]

122567-97-9
[Synonyms]

-deoxythymidine
Benzoyl stavudine
-didehydro-3&rsquo
-O-Benzoyl-2&rsquo
Stavudine impurity I
Stavudine EP Impurity I
Stavudine impurity I CRS
Uridine Related Compound 1
5′-O-Benzoyl-2′,3′-didehydro-3′-deoxythymidine
Thymidine, 2',3'-didehydro-3'-deoxy-, 5'-benzoate
[(2S,5R)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl benzoate
benzoic acid [5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2,5-dihydrofuran-2-yl]methyl ester
((2S,5R)-5-(5-Methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-2,5-dihydrofuran-2-yl)methyl benzoate
[Molecular Formula]

C17H16N2O5
[MDL Number]

MFCD00871194
[MOL File]

122567-97-9.mol
[Molecular Weight]

328.32
Chemical PropertiesBack Directory
[storage temp. ]

Inert atmosphere,Room Temperature
[Major Application]

pharmaceutical (small molecule)
[InChI]

1S/C17H16N2O5/c1-11-9-19(17(22)18-15(11)20)14-8-7-13(24-14)10-23-16(21)12-5-3-2-4-6-12/h2-9,13-14H,10H2,1H3,(H,18,20,22)/t13-,14+/m0/s1
[InChIKey]

BKZQWZPYZIYYAQ-UONOGXRCSA-N
[SMILES]

[nH]1[c]([n](cc([c]1=O)C)[C@@H]2O[C@@H](C=C2)COC(=O)c3ccccc3)=O
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

5''-O-Benzoyl-2'',3''-didehydro-3''-deoxythymidine is a reactant used in the synthetic preparation of the anti-AIDS drug Stavudine (S685250), and preparation of anti-HIV agent Stavudine analogs.
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