3-(hydroxymethyl)-5-(6-methylsulfanylpurin-9-yl)-1,4-dioxane-2,6-diol
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3-(hydroxymethyl)-5-(6-methylsulfanylpurin-9-yl)-1,4-dioxane-2,6-diol
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CAS No:
51112-62-0
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Formula:
C11H14N4O5S
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Chemical Name:
3-(hydroxymethyl)-5-(6-methylsulfanylpurin-9-yl)-1,4-dioxane-2,6-diol
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Synonyms:
NSC111702;51112-62-0;3-(hydroxymethyl)-5-(6-(methylthio)-9H-purin-9-yl)-1,4-dioxane-2,6-diol;NSC-111702;CHEMBL1998204;DTXSID50296815;3-(hydroxymethyl)-5-(6-methylsulfanylpurin-9-yl)-1,4-dioxane-2,6-diol;NCI60_000261;DS-004610;A7588;N-Methyl(1,3,5-trimethyl-1H-pyrazol-4-yl)methanamine;p-Dioxane-2-methanol,5-dihydroxy-6-[6-(methylthio)-9H-purin-9-yl]-
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CAS No:
3-(hydroxymethyl)-5-(6-methylsulfanylpurin-9-yl)-1,4-dioxane-2,6-diol Basic Attributes
314.32 g/mol
314.06849073 g/mol
111702
DTXSID50296815
Computed Properties
Molecular Weight:314.32
XLogP3:0.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:3
Exact Mass:314.06849073
Monoisotopic Mass:314.06849073
Topological Polar Surface Area:148
Heavy Atom Count:21
Complexity:368
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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