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(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolane-3-carbonitrile

(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolane-3-carbonitrile structure

CAS No:
121123-91-9
Formula:
C11H12N6O3
Chemical Name:
(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolane-3-carbonitrile
Synonyms:
CNddA;3'-C-cyano-3'-deoxyadenosine;Adenosine, 3'-cyano-3'-deoxy-;121123-91-9;CHEMBL2114992;DTXSID20153163;(2S,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-carbonitrile;(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-carbonitrile

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(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolane-3-carbonitrile Basic Attributes

Molecular Weight：

276.25 g/mol

Exact Mass：

276.09708827 g/mol

DSSTox ID：

DTXSID20153163

Characteristics

PSA：

143 Å²

Computed Properties

Molecular Weight:276.25
XLogP3:-0.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:2
Exact Mass:276.09708827
Monoisotopic Mass:276.09708827
Topological Polar Surface Area:143
Heavy Atom Count:20
Complexity:414
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolane-3-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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