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Home Other Building Blocks Adenosine, 2-methyl-

Adenosine, 2-methyl-

CAS No.:
16526-56-0
Catalog Number:
AG001W1X
Molecular Formula:
C11H15N5O4
Molecular Weight:
281.2679
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Product Description
Catalog Number:
AG001W1X
Chemical Name:
Adenosine, 2-methyl-
CAS Number:
16526-56-0
Molecular Formula:
C11H15N5O4
Molecular Weight:
281.2679
MDL Number:
MFCD22380880
IUPAC Name:
(2R,3R,4S,5R)-2-(6-amino-2-methylpurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
InChI:
InChI=1S/C11H15N5O4/c1-4-14-9(12)6-10(15-4)16(3-13-6)11-8(19)7(18)5(2-17)20-11/h3,5,7-8,11,17-19H,2H2,1H3,(H2,12,14,15)/t5-,7-,8-,11-/m1/s1
InChI Key:
IQZWKGWOBPJWMX-IOSLPCCCSA-N
SMILES:
OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(C)nc2N
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
281.112g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
281.272g/mol
Monoisotopic Mass:
281.112g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
140A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Literature
Title Journal
6-Oxo and 6-thio purine analogs as antimycobacterial agents. Bioorganic & medicinal chemistry 20130401
Synthesis, biological activity, and SAR of antimycobacterial 9-aryl-, 9-arylsulfonyl-, and 9-benzyl-6-(2-furyl)purines. Journal of medicinal chemistry 20050407
Metabolism of 2-methyladenosine in Mycobacterium tuberculosis. Tuberculosis (Edinburgh, Scotland) 20040101
Antimycobacterial activity of 2-methyl-adenosine. The Journal of antimicrobial chemotherapy 20031101
Identification and characterization of a unique adenosine kinase from Mycobacterium tuberculosis. Journal of bacteriology 20031101
Inhibition of hepatitis C virus RNA replication by 2'-modified nucleoside analogs. The Journal of biological chemistry 20030404
The metabolism of 2-methyladenosine in Mycobacterium smegmatis. Microbiology (Reading, England) 20020101
Antiviral agents. 1-Aralkyloxyadenosines. Journal of medicinal chemistry 19740301
Properties