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51350-19-7

51350-19-7 structural image
Product Name: EHNA HYDROCHLORIDE
Formula: C14H23N5O
Synonyms: erythro-9-(2-Hydroxy-3-nonyl)-adenine hydrochloride;erythro-9-(2-Hydroxy-3-nonyl)adenine, HCl;erythro-9-Amino-β-hexyl--α-methyl-9H-purine-9-ethanol hydrochloride;EHNA, Hydrochloride - CAS 51350-19-7 - Calbiochem
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COMPUTED DESCRIPTORS

Molecular Weight 277.37 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 7
Exact Mass 277.19026037 g/mol
Monoisotopic Mass 277.19026037 g/mol
Topological Polar Surface Area 89.8 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 291
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

(2R,3S)-EHNA is eHNA of absolute configuration 2R,3S. Selective inhibitor of cGMP-stimulated phosphodiesterase (PDE2) (IC50 = 0.8 - 4 mM). Also a potent inhibitor of adenosine deaminase. It has a role as an EC 3.5.4.4 (adenosine deaminase) inhibitor and an EC 3.1.4.* (phosphoric diester hydrolase) inhibitor. It is a conjugate base of a (2R,3S)-EHNA(1+). It is an enantiomer of a (2S,3R)-EHNA.