Home Other Building Blocks 6-thioinosine 5'-monophosphate

6-thioinosine 5'-monophosphate

CAS No.:
53-83-8
Catalog Number:
AG00DEW6
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00DEW6
Chemical Name:
6-thioinosine 5'-monophosphate
CAS Number:
53-83-8
MDL Number:
MFCD18252517
IUPAC Name:
[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate
InChI:
InChI=1S/C10H13N4O7PS/c15-6-4(1-20-22(17,18)19)21-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)23/h2-4,6-7,10,15-16H,1H2,(H,11,12,23)(H2,17,18,19)/t4-,6-,7-,10-/m1/s1
InChI Key:
ZKRFOXLVOKTUTA-KQYNXXCUSA-N
EC Number:
200-183-9
UNII:
76CK4YA5ZP
Properties
Complexity:
559  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
364.024g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
364.269g/mol
Monoisotopic Mass:
364.024g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
191A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.2  
Literature
Title Journal
Commentary on: Differences in nucleotide hydrolysis contribute to the differences between erythrocyte 6-thioguanine nucleotide concentrations determined by two widely used methods. Clinical chemistry 20030901
Effect of methotrexate polyglutamates on thioguanine nucleotide concentrations during continuation therapy of acute lymphoblastic leukemia with mercaptopurine. Leukemia 20020201
Properties