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3475-65-8,MFCD03427532
Catalog No.:AA00CZHZ

3475-65-8 | 2-(3-((4-Amino-2-methylpyrimidin-5-yl)methyl)-4-methylthiazol-3-ium-5-yl)ethyl trihydrogen triphosphate

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2.5mg
3 weeks  
$528.00   $369.00
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25mg
3 weeks  
$2,953.00   $2,067.00
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  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00CZHZ
Chemical Name:
2-(3-((4-Amino-2-methylpyrimidin-5-yl)methyl)-4-methylthiazol-3-ium-5-yl)ethyl trihydrogen triphosphate
CAS Number:
3475-65-8
Molecular Formula:
C12H19N4O10P3S
Molecular Weight:
504.2863
MDL Number:
MFCD03427532
SMILES:
Cc1ncc(c(n1)N)C[n+]1csc(c1C)CCOP(=O)(OP(=O)(OP(=O)(O)[O-])O)O
Properties
Computed Properties
 
Complexity:
728  
Covalently-Bonded Unit Count:
1  
Formal Charge:
1  
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
14  
Hydrogen Bond Donor Count:
5  
Rotatable Bond Count:
10  
XLogP3:
-2.3  

Literature

Title: Thiamin(e): the spark of life.

Journal: Sub-cellular biochemistry 20120101

Title: A specific inorganic triphosphatase from Nitrosomonas europaea: structure and catalytic mechanism.

Journal: The Journal of biological chemistry 20110930

Title: [Thiamine and its derivatives in the regulation of cell metabolism].

Journal: Postepy higieny i medycyny doswiadczalnej (Online) 20110706

Title: Adenosine thiamine triphosphate (AThTP) inhibits poly(ADP-ribose) polymerase-1 (PARP-1) activity.

Journal: Journal of nutritional science and vitaminology 20110101

Title: Thiamine triphosphate synthesis in rat brain occurs in mitochondria and is coupled to the respiratory chain.

Journal: The Journal of biological chemistry 20100101

Title: Adenosine thiamine triphosphate accumulates in Escherichia coli cells in response to specific conditions of metabolic stress.

Journal: BMC microbiology 20100101

Title: [Existence of two different active sites on thiamine binding protein in plasma membranes of synaptosomes].

Journal: Ukrains'kyi biokhimichnyi zhurnal (1999 ) 20100101

Title: Thiamine status in humans and content of phosphorylated thiamine derivatives in biopsies and cultured cells.

Journal: PloS one 20100101

Title: Degradation and conversion of thiamin and thiamin phosphate esters in fresh stored pork and in raw sausages.

Journal: Meat science 20091101

Title: Thiaminylated adenine nucleotides. Chemical synthesis, structural characterization and natural occurrence.

Journal: The FEBS journal 20090601

Title: Thiamin diphosphate in biological chemistry: new aspects of thiamin metabolism, especially triphosphate derivatives acting other than as cofactors.

Journal: The FEBS journal 20090601

Title: Dysautonomia, a heuristic approach to a revised model for etiology of disease.

Journal: Evidence-based complementary and alternative medicine : eCAM 20090301

Title: [Vitamin B1: metabolism and functions].

Journal: Biomeditsinskaia khimiia 20090101

Title: [Characteristics of thiamine triphosphatase from neural cells plasma membranes].

Journal: Ukrains'kyi biokhimichnyi zhurnal (1999 ) 20090101

Title: The iron-regulated metastasis suppressor, Ndrg-1: identification of novel molecular targets.

Journal: Biochimica et biophysica acta 20081001

Title: Structural basis for the catalytic mechanism of mammalian 25-kDa thiamine triphosphatase.

Journal: The Journal of biological chemistry 20080418

Title: Thiamin phosphates in egg yolk granules and plasma of regular and embryonated eggs of hens and in five- and seven-day-old embryos.

Journal: Poultry science 20080101

Title: Adenylate kinase-independent thiamine triphosphate accumulation under severe energy stress in Escherichia coli.

Journal: BMC microbiology 20080101

Title: Benfotiamine, a synthetic S-acyl thiamine derivative, has different mechanisms of action and a different pharmacological profile than lipid-soluble thiamine disulfide derivatives.

Journal: BMC pharmacology 20080101

Title: [Thiamine metabolism disorders in the rat brain in experimental alcoholism and a possibility of their correction by vitamin E].

Journal: Ukrains'kyi biokhimichnyi zhurnal (1999 ) 20080101

Title: Three case reports to illustrate clinical applications in the use of erythrocyte transketolase.

Journal: Evidence-based complementary and alternative medicine : eCAM 20070601

Title: Discovery of a natural thiamine adenine nucleotide.

Journal: Nature chemical biology 20070401

Title: Adenosine triphosphate and thiamine cross paths.

Journal: Nature chemical biology 20070401

Title: Regulation of metabolic networks by small molecule metabolites.

Journal: BMC bioinformatics 20070101

Title: Presence of thiamine pyrophosphate in mammalian peroxisomes.

Journal: BMC biochemistry 20070101

Title: Thiamine diphosphate adenylyl transferase from E. coli: functional characterization of the enzyme synthesizing adenosine thiamine triphosphate.

Journal: BMC biochemistry 20070101

Title: Potent radical-scavenging activities of thiamin and thiamin diphosphate.

Journal: Journal of clinical biochemistry and nutrition 20070101

Title: A review of the biochemistry, metabolism and clinical benefits of thiamin(e) and its derivatives.

Journal: Evidence-based complementary and alternative medicine : eCAM 20060301

Title: ATP release via anion channels.

Journal: Purinergic signalling 20051201

Title: Simultaneous kinetic characterization of multiple protein forms by top down mass spectrometry.

Journal: Journal of the American Society for Mass Spectrometry 20050701

Title: Structural characterization of the regulatory proteins TenA and TenI from Bacillus subtilis and identification of TenA as a thiaminase II.

Journal: Biochemistry 20050222

Title: Assay values for thiamine or thiamine phosphate esters in whole blood do not depend on the anticoagulant used.

Journal: Journal of clinical laboratory analysis 20050101

Title: The biosynthesis of the thiazole phosphate moiety of thiamin: the sulfur transfer mediated by the sulfur carrier protein ThiS.

Journal: Chemistry & biology 20041001

Title: Human recombinant thiamine triphosphatase: purification, secondary structure and catalytic properties.

Journal: The international journal of biochemistry & cell biology 20040701

Title: Thiamine triphosphate, a new signal required for optimal growth of Escherichia coli during amino acid starvation.

Journal: The Journal of biological chemistry 20040423

Title: Thiamin deficiency and brain disorders.

Journal: Nutrition research reviews 20031201

Title: A general method for the chemical synthesis of gamma-32P-labeled or unlabeled nucleoside 5(')-triphosphates and thiamine triphosphate.

Journal: Analytical biochemistry 20031115

Title: Thiamine triphosphate and thiamine triphosphatase activities: from bacteria to mammals.

Journal: Cellular and molecular life sciences : CMLS 20030701

Title: [Intracellular localization of thiamine-binding proteins in the liver and kidneys of rats].

Journal: Ukrains'kyi biokhimichnyi zhurnal (1999 ) 20030101

Title: Adenylate kinase 1 knockout mice have normal thiamine triphosphate levels.

Journal: Biochimica et biophysica acta 20021021

Title: Synthesis of stable analogues of thiamine di- and triphosphate as tools for probing a new phosphorylation pathway.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20021018

Title: Thiamine deficiency in hepatitis C virus and alcohol-related liver diseases.

Journal: Digestive diseases and sciences 20020301

Title: Simultaneous detection of thiamine and its phosphate esters from microalgae by HPLC.

Journal: Biochemical and biophysical research communications 20020222

Title: The catalytic domains of thiamine triphosphatase and CyaB-like adenylyl cyclase define a novel superfamily of domains that bind organic phosphates.

Journal: BMC genomics 20020101

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Tags:3475-65-8 Molecular Formula|3475-65-8 MDL|3475-65-8 SMILES|3475-65-8 2-(3-((4-Amino-2-methylpyrimidin-5-yl)methyl)-4-methylthiazol-3-ium-5-yl)ethyl trihydrogen triphosphate