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611-53-0

611-53-0 | 5-Iodo-2'-deoxycytidine

CAS No: 611-53-0 Catalog No: AG0038LW MDL No:MFCD00038063

Product Description

Catalog Number:
AG0038LW
Chemical Name:
5-Iodo-2'-deoxycytidine
CAS Number:
611-53-0
Molecular Formula:
C9H12IN3O4
Molecular Weight:
353.1137
MDL Number:
MFCD00038063
IUPAC Name:
4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidin-2-one
InChI:
InChI=1S/C9H12IN3O4/c10-4-2-13(9(16)12-8(4)11)7-1-5(15)6(3-14)17-7/h2,5-7,14-15H,1,3H2,(H2,11,12,16)/t5-,6+,7+/m0/s1
InChI Key:
WEVJJMPVVFNAHZ-RRKCRQDMSA-N
SMILES:
OC[C@H]1O[C@H](C[C@@H]1O)n1cc(I)c(nc1=O)N
EC Number:
210-269-8
UNII:
3EK8532DZV

Properties

Complexity:
398  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
0
Exact Mass:
352.987g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
353.116g/mol
Monoisotopic Mass:
352.987g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  

Literature

Title Journal
Improved synthesis and mutagenicity of oligonucleotides containing 5-hydroxymethylcytosine, 5-formylcytosine and 5-carboxylcytosine. Chemistry (Weinheim an der Bergstrasse, Germany) 20111202
Fluorescent pyrimidopyrimidoindole nucleosides: control of photophysical characterizations by substituent effects. The Journal of organic chemistry 20070706
MIA (melanoma inhibitory activity) promoter mediated tissue-specific suicide gene therapy of malignant melanoma. Cancer gene therapy 20040601
Asymmetric photocross-linking pattern of restriction endonuclease EcoRII to the DNA recognition sequence. The Journal of biological chemistry 20020419
X-ray analyses of d(GCGAAAGC) and d(GXGAAAGCT), where X = 2'-deoxy-5-iodocytidine. Nucleic acids research. Supplement (2001) 20010101
Efficacy of select antivirals against Cryptosporidium parvum in vitro. FEMS microbiology letters 19981101
In vitro susceptibility of varicella-zoster virus to E-5-(2-bromovinyl)-2'-deoxyuridine and related compounds. Antimicrobial agents and chemotherapy 19820101
Relative potencies of different anti-herpes agents in the topical treatment of cutaneous herpes simplex virus infection of athymic nude mice. Antimicrobial agents and chemotherapy 19791101
Nucleosides. 110. Synthesis and antiherpes virus activity of some 2'-fluoro-2'-deoxyarabinofuranosylpyrimidine nucleosides. Journal of medicinal chemistry 19790101

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