[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-imidazol-1-ylphosphinic acid
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![[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-imidazol-1-ylphosphinic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/1625e3a0730f48a481be4c12ce56b991.png "[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-imidazol-1-ylphosphinic acid")
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-imidazol-1-ylphosphinic acid
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CAS No:
20816-58-4
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Formula:
C13H16N7O6P
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Chemical Name:
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-imidazol-1-ylphosphinic acid
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Synonyms:
adenosine 5'-phosphoroimidazolide;20816-58-4;Adenosine 5'-phosphoroimidazolide;SCHEMBL12304452;1-(5'-Adenylyl)-1H-imidazole;DTXSID00943064;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-imidazol-1-ylphosphinic acid;Adenosine, 5'-(hydrogen 1H-imidazol-1-ylphosphonate);9-{5-O-[Hydroxy(1H-imidazol-1-yl)phosphoryl]pentofuranosyl}-9H-purin-6-amine
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CAS No:
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-imidazol-1-ylphosphinic acid Basic Attributes
397.28 g/mol
397.08996825 g/mol
Computed Properties
Molecular Weight:397.28
XLogP3:-2.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:5
Exact Mass:397.08996825
Monoisotopic Mass:397.08996825
Topological Polar Surface Area:184
Heavy Atom Count:27
Complexity:589
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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