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(2S,3S,4R,5R)-2-(2-aminoethylsulfanylmethyl)-5-(6-aminopurin-9-yl)oxolane-3,4-diol

(2S,3S,4R,5R)-2-(2-aminoethylsulfanylmethyl)-5-(6-aminopurin-9-yl)oxolane-3,4-diol structure

CAS No:
38716-43-7
Formula:
C12H18N6O3S
Chemical Name:
(2S,3S,4R,5R)-2-(2-aminoethylsulfanylmethyl)-5-(6-aminopurin-9-yl)oxolane-3,4-diol
Synonyms:
5'-deoxy-5'-[2-(amino)ethylthio]adenosine;CHEMBL563938;5'-[2-(amino)ethylthio]-5'-deoxyadenosine;SCHEMBL5055464;BDBM50294573;(2S,3S,4R,5R)-2-(2-aminoethylsulfanylmethyl)-5-(6-aminopurin-9-yl)oxolane-3,4-diol;5'-S-(2-aminoethyl)-5'-thioadenosine;38716-43-7;5''-(Aminoethylthio)-5''-deoxy-adenosine;5''-DEOXY-5''-[2-(AMINO)ETHYLTHIO]ADENOSINE;Q27463769;(2R,3R,4S,5S)-2-(6-amino-9H-purin-9-yl)-5-((2-aminoethylthio)methyl)tetrahydrofuran-3,4-diol

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(2S,3S,4R,5R)-2-(2-aminoethylsulfanylmethyl)-5-(6-aminopurin-9-yl)oxolane-3,4-diol Basic Attributes

Molecular Weight：

326.38 g/mol

Exact Mass：

326.11610963 g/mol

Characteristics

PSA：

171 Å²

XLogP3：

0.0011

Computed Properties

Molecular Weight:326.38
XLogP3:-1.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:326.11610963
Monoisotopic Mass:326.11610963
Topological Polar Surface Area:171
Heavy Atom Count:22
Complexity:381
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2S,3S,4R,5R)-2-(2-aminoethylsulfanylmethyl)-5-(6-aminopurin-9-yl)oxolane-3,4-diol

Basic Attributes
Characteristics
Computed Properties

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