(2R,3R,4S,5R)-2-[6-amino-2-[2-(4-methylphenyl)ethoxy]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
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![(2R,3R,4S,5R)-2-[6-amino-2-[2-(4-methylphenyl)ethoxy]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/48a8cfc65eb6423f89e1043467e1b63d.png "(2R,3R,4S,5R)-2-[6-amino-2-[2-(4-methylphenyl)ethoxy]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol")
(2R,3R,4S,5R)-2-[6-amino-2-[2-(4-methylphenyl)ethoxy]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
structure -
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CAS No:
131865-94-6
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Formula:
C19H23N5O5
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Chemical Name:
(2R,3R,4S,5R)-2-[6-amino-2-[2-(4-methylphenyl)ethoxy]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
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Synonyms:
2-(2-(4-methylphenyl)ethoxy)adenosine;2-(2-(p-methylphenyl)ethoxy)adenosine;SHA 118;SHA-118;WRC 0090;WRC-0090;2-(2-(4-Methylphenyl)ethoxy)adenosine;131865-94-6;SHA-118;2-(2-(p-Methylphenyl)ethoxy)adenosine;(2R,3R,4S,5R)-2-[6-amino-2-[2-(4-methylphenyl)ethoxy]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol;2-[2-(p-methylphenyl)ethoxy]adenosine;Sha 118;Wrc 0090;Wrc-0090;SCHEMBL2296467;DTXSID00157240;ZINC3802216;Adenosine, 2-(2-(4-methylphenyl)ethoxy)-;(2R,3R,4S,5R)-2-(6-Amino-2-(4-methylphenethoxy)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
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CAS No:
(2R,3R,4S,5R)-2-[6-amino-2-[2-(4-methylphenyl)ethoxy]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Basic Attributes
401.4 g/mol
401.16991885 g/mol
DTXSID00157240
Computed Properties
Molecular Weight:401.4
XLogP3:1.6
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:401.16991885
Monoisotopic Mass:401.16991885
Topological Polar Surface Area:149
Heavy Atom Count:29
Complexity:537
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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