[(2S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-2-yl]methoxy-N-[(E)-dec-4-enyl]phosphonamidic acid
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![[(2S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-2-yl]methoxy-N-[(E)-dec-4-enyl]phosphonamidic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f512ebcedb3b4c41997c8ee1848b7f2a.png "[(2S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-2-yl]methoxy-N-[(E)-dec-4-enyl]phosphonamidic acid")
[(2S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-2-yl]methoxy-N-[(E)-dec-4-enyl]phosphonamidic acid
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CAS No:
140686-45-9
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Formula:
C20H33N6O5P
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Chemical Name:
[(2S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-2-yl]methoxy-N-[(E)-dec-4-enyl]phosphonamidic acid
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Synonyms:
ACDPA; Adenosine,cyclic 3',5'-(decylphosphoramidate); Adenosine 3',5'-cyclic decylphosphoramidate;
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CAS No:
[(2S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-2-yl]methoxy-N-[(E)-dec-4-enyl]phosphonamidic acid Basic Attributes
468.48700
468.22500517
Computed Properties
Molecular Weight:468.5
XLogP3:1.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:13
Exact Mass:468.22500517
Monoisotopic Mass:468.22500517
Topological Polar Surface Area:158
Heavy Atom Count:32
Complexity:644
Defined Atom Stereocenter Count:3
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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