2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,7-dimethylpurine-6,8-dione
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2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,7-dimethylpurine-6,8-dione
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CAS No:
27963-78-6
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Formula:
C12H17N5O6
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Chemical Name:
2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,7-dimethylpurine-6,8-dione
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Synonyms:
27963-78-6;NSC127518;DTXSID40950651;NSC-127518;2-Imino-1,7-dimethyl-9-pentofuranosyl-2,3,7,9-tetrahydro-1H-purine-6,8-dione
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CAS No:
2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,7-dimethylpurine-6,8-dione Basic Attributes
327.29 g/mol
327.11788328 g/mol
127518
Computed Properties
Molecular Weight:327.29
XLogP3:-3.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:327.11788328
Monoisotopic Mass:327.11788328
Topological Polar Surface Area:152
Heavy Atom Count:23
Complexity:633
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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