CAS 2504-55-4 | Adenosine, 3'-amino-3'-deoxy- | CAS Number 2504-55-4

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2504-55-4 | Adenosine, 3'-amino-3'-deoxy-

CAS No: 2504-55-4 Catalog No: AG002Q9S MDL No:

Product Description

Catalog Number:

AG002Q9S

Chemical Name:

Adenosine, 3'-amino-3'-deoxy-

CAS Number:

2504-55-4

Molecular Formula:

C10H14N6O3

Molecular Weight:

266.2566

IUPAC Name:

(2R,3R,4S,5S)-4-amino-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolan-3-ol

InChI:

InChI=1S/C10H14N6O3/c11-5-4(1-17)19-10(7(5)18)16-3-15-6-8(12)13-2-14-9(6)16/h2-5,7,10,17-18H,1,11H2,(H2,12,13,14)/t4-,5-,7-,10-/m1/s1

InChI Key:

ILDPUOKUEKVHIL-QYYRPYCUSA-N

SMILES:

OC[C@H]1O[C@H]([C@@H]([C@@H]1N)O)n1cnc2c1ncnc2N

Properties

Complexity:

334

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

266.113g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

266.261g/mol

Monoisotopic Mass:

266.113g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

145A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.3

Literature

Title	Journal
The shortest synthetic route to puromycin analogues using a modified Robins approach.	The Journal of organic chemistry 20110401
Betulin-derived compounds as inhibitors of alphavirus replication.	Journal of natural products 20091101
A luciferase-based screening method for inhibitors of alphavirus replication applied to nucleoside analogues.	Antiviral research 20080601
Expression in Escherichia coli of a recombinant adenosine kinase from Saccharomyces cerevisiae: purification, kinetics and substrate analyses.	Yeast (Chichester, England) 20031015
A practical route to 3'-amino-3'-deoxyadenosine derivatives and puromycin analogues.	The Journal of organic chemistry 20030307
Identification of a set of genes involved in the biosynthesis of the aminonucleoside moiety of antibiotic A201A from Streptomyces capreolus.	European journal of biochemistry 20021101
Neoceptor concept based on molecular complementarity in GPCRs: a mutant adenosine A(3) receptor with selectively enhanced affinity for amine-modified nucleosides.	Journal of medicinal chemistry 20011122