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4160-72-9,MFCD00047494
Catalog No.:AA00C0AX

4160-72-9 | 1-METHYLTHYMINE

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50mg
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$193.00   $135.00
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100mg
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$231.00   $162.00
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250mg
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$281.00   $197.00
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500mg
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$377.00   $264.00
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1g
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$452.00   $317.00
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2.5g
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$825.00   $578.00
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5g
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$1,517.00   $1,062.00
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10g
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$2,850.00   $1,995.00
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  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00C0AX
Chemical Name:
1-METHYLTHYMINE
CAS Number:
4160-72-9
Molecular Formula:
C6H8N2O2
Molecular Weight:
140.1399
MDL Number:
MFCD00047494
SMILES:
Cc1cn(C)c(=O)[nH]c1=O
NSC Number:
44824
Properties
Computed Properties
 
Complexity:
220  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
XLogP3:
-0.5  

Literature

Title: Mechanistic studies of the radical SAM enzyme spore photoproduct lyase (SPL).

Journal: Biochimica et biophysica acta 20121101

Title: Initial excited-state structural dynamics of thymine derivatives.

Journal: The journal of physical chemistry. B 20120906

Title: N-h and N-C bond activation of pyrimidinic nucleobases and nucleosides promoted by an osmium polyhydride.

Journal: Inorganic chemistry 20120521

Title: Structural basis for sequence-specific DNA recognition by an Arabidopsis WRKY transcription factor.

Journal: The Journal of biological chemistry 20120302

Title: The (α-4) photoconjugates of 5-methylcytosine, 1,5-dimethylcytosine, 1-methylthymine and thymidine.

Journal: Photochemistry and photobiology 20120101

Title: Determinants of bacteriophage 933W repressor DNA binding specificity.

Journal: PloS one 20120101

Title: C(5) modified uracil derivatives showing antiproliferative and erythroid differentiation inducing activities on human chronic myelogenous leukemia K562 cells.

Journal: European journal of pharmacology 20111215

Title: A new N-methyl thymine derivative comprising a dihydroxyisobutenyl unit as ligand for thymidine kinase of herpes simplex virus type 1 (HSV-1 TK).

Journal: Bioorganic & medicinal chemistry letters 20111015

Title: Noncovalent interactions in paired DNA nucleobases investigated by terahertz spectroscopy and solid-state density functional theory.

Journal: The journal of physical chemistry. A 20110901

Title: Specific photodynamics in thymine clusters: the role of hydrogen bonding.

Journal: The journal of physical chemistry. A 20110901

Title: On the nature of the long-lived 'dark' state of isolated 1-methylthymine.

Journal: Chemphyschem : a European journal of chemical physics and physical chemistry 20110711

Title: Relationship between amino acid composition and gene expression in the mouse genome.

Journal: BMC research notes 20110101

Title: Genome wide SNP discovery, analysis and evaluation in mallard (Anas platyrhynchos).

Journal: BMC genomics 20110101

Title: The (5-4) and (6-4) adducts of 1-methylthymine and their Dewar valence isomers.

Journal: Photochemistry and photobiology 20110101

Title: A codon substitution model that incorporates the effect of the GC contents, the gene density and the density of CpG islands of human chromosomes.

Journal: BMC genomics 20110101

Title: Structural basis for sequence specific DNA binding and protein dimerization of HOXA13.

Journal: PloS one 20110101

Title: Analysis of CpG methylation sites and CGI among human papillomavirus DNA genomes.

Journal: BMC genomics 20110101

Title: DNA Interaction and DNA Cleavage Studies of a New Platinum(II) Complex Containing Aliphatic and Aromatic Dinitrogen Ligands.

Journal: Bioinorganic chemistry and applications 20110101

Title: Photoinduced ring opening reactions and subsequent thermal ring closure reactions in the thymine-ammonia system and related systems.

Journal: Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20100924

Title: The anionic (9-methyladenine)-(1-methylthymine) base pair solvated by formic acid. A computational and photoelectron spectroscopy study.

Journal: The journal of physical chemistry. B 20100902

Title: Structural and kinetic characterization of human deoxycytidine kinase variants able to phosphorylate 5-substituted deoxycytidine and thymidine analogues .

Journal: Biochemistry 20100810

Title: Formation of aminyl radicals on electron attachment to AZT: abstraction from the sugar phosphate backbone versus one-electron oxidation of guanine.

Journal: The journal of physical chemistry. B 20100722

Title: Ab initio investigation of the methylation and hydration effects on the electronic spectra of uracil and thymine.

Journal: Physical chemistry chemical physics : PCCP 20100521

Title: Energy barriers between H-bonded and stacked structures of 9-methyladenine...1-methylthymine and 9-methylguanine...1-methylcytosine complexes.

Journal: Chemical communications (Cambridge, England) 20100121

Title: A novel FRET pair for detection of parallel DNA triplexes by the LightCycler.

Journal: BMC biotechnology 20100101

Title: The NMR restraints grid at BMRB for 5,266 protein and nucleic acid PDB entries.

Journal: Journal of biomolecular NMR 20091201

Title: Intersystem crossing and characterization of dark states in the pyrimidine nucleobases uracil, thymine, and 1-methylthymine.

Journal: The journal of physical chemistry. A 20091029

Title: Mechanisms of base selection by human single-stranded selective monofunctional uracil-DNA glycosylase.

Journal: The Journal of biological chemistry 20090605

Title: Role of the ancillary ligands on the stabilization of the imino-oxo tautomer of 1-methylcytosine in Pt(II) complexes.

Journal: Dalton transactions (Cambridge, England : 2003) 20090407

Title: Methylation-dependent binding of the epstein-barr virus BZLF1 protein to viral promoters.

Journal: PLoS pathogens 20090301

Title: Rare tautomers of 1-methyluracil and 1-methylthymine: tuning relative stabilities through coordination to PtII complexes.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20090101

Title: Insights into the role of Val45 and Gln182 of Escherichia coli MutY in DNA substrate binding and specificity.

Journal: BMC biochemistry 20090101

Title: The WUS homeobox-containing (WOX) protein family.

Journal: Genome biology 20090101

Title: Multinuclear NMR and kinetic analysis of DNA interstrand cross-link formation.

Journal: Journal of the American Chemical Society 20081231

Title: Electronic and vibrational spectroscopy of 1-methylthymine and its water clusters: the dark state survives hydration.

Journal: Chemphyschem : a European journal of chemical physics and physical chemistry 20080804

Title: Patterns of evolution and host gene mimicry in influenza and other RNA viruses.

Journal: PLoS pathogens 20080601

Title: Measurement of the incorporation and repair of exogenous 5-hydroxymethyl-2'-deoxyuridine in human cells in culture using gas chromatography-negative chemical ionization-mass spectrometry.

Journal: Chemical research in toxicology 20071201

Title: Ab initio base-pairing energies of an oxidized thymine product, 5-formyluracil, with standard DNA bases at the BSSE-free DFT and MP2 theory levels.

Journal: Organic & biomolecular chemistry 20070521

Title: Theoretical model of infrared spectra of hydrogen bonds in molecular crystals and its application to interpretation of infrared spectra of 1-methylthymine.

Journal: The Journal of chemical physics 20060828

Title: Palladium(II) and platinum(II) organometallic complexes with the model nucleobase anions of thymine, uracil, and cytosine: antitumor activity and interactions with DNA of the platinum compounds.

Journal: Inorganic chemistry 20060807

Title: Vibrational Feshbach resonances in uracil and thymine.

Journal: The Journal of chemical physics 20060328

Title: DNA intramolecular triplexes containing dT --> dU substitutions: unfolding energetics and ligand binding.

Journal: Biochemistry 20060307

Title: Non-cognate enzyme-DNA complex: structural and kinetic analysis of EcoRV endonuclease bound to the EcoRI recognition site GAATTC.

Journal: Journal of molecular biology 20051118

Title: DNA adducts of the enantiomers of the Pt(II) complexes of the ahaz ligand (ahaz=3-aminohexahydroazepine) and recognition of these adducts by HMG domain proteins.

Journal: Biochemical and biophysical research communications 20050715

Title: AT base pair anions versus (9-methyl-A)(1-methyl-T) base pair anions.

Journal: Journal of the American Chemical Society 20050504

Title: Vibrational spectra of 1-methylthymine: matrix isolation, solid state and theoretical studies.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20040701

Title: 5-Formyluracil-induced perturbations of DNA function.

Journal: Biochemistry 20040518

Title: A molecular dissection of the interaction between the transcription factor Gata-1 zinc finger and DNA.

Journal: Biochemical and biophysical research communications 20040409

Title: 1H NMR studies of nickel(II) complexes bound to oligonucleotides: a novel technique for distinguishing the binding locations of metal complexes in DNA.

Journal: Inorganic chemistry 20031229

Title: True stabilization energies for the optimal planar hydrogen-bonded and stacked structures of guanine...cytosine, adenine...thymine, and their 9- and 1-methyl derivatives: complete basis set calculations at the MP2 and CCSD(T) levels and comparison with experiment.

Journal: Journal of the American Chemical Society 20031217

Title: Anatomy of specific interactions between lambda repressor and operator DNA.

Journal: Proteins 20031001

Title: Reactivity of substituted charged phenyl radicals toward components of nucleic acids.

Journal: Journal of the American Chemical Society 20030226

Title: Repair of the mutagenic DNA oxidation product, 5-formyluracil.

Journal: DNA repair 20030203

Title: Pyrazolylborate-zinc-nucleobase-complexes, 3:(1) base pairing studies.

Journal: Inorganic chemistry 20021118

Title: Endogenous DNA lesions can inhibit the binding of the AP-1 (c-Jun) transcription factor.

Journal: Biochemistry 20020625

Title: Thymine-metal ion interactions: relevance for thymine quartet structures.

Journal: Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry 20010401

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