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70-40-6

70-40-6 | 3,3'-diiodothyronine

CAS No: 70-40-6 Catalog No: AG00FEJX MDL No:

Product Description

Catalog Number:
AG00FEJX
Chemical Name:
3,3'-diiodothyronine
CAS Number:
70-40-6
IUPAC Name:
2-amino-3-[4-(4-hydroxy-3-iodophenoxy)-3-iodophenyl]propanoic acid
InChI:
InChI=1S/C15H13I2NO4/c16-10-7-9(2-3-13(10)19)22-14-4-1-8(5-11(14)17)6-12(18)15(20)21/h1-5,7,12,19H,6,18H2,(H,20,21)
InChI Key:
CPCJBZABTUOGNM-UHFFFAOYSA-N

Properties

Complexity:
385  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
524.893g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
525.081g/mol
Monoisotopic Mass:
524.893g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
92.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

Literature

Title Journal
Regioselective deiodination of thyroxine by iodothyronine deiodinase mimics: an unusual mechanistic pathway involving cooperative chalcogen and halogen bonding. Journal of the American Chemical Society 20120307
Halogenated phenolic contaminants inhibit the in vitro activity of the thyroid-regulating deiodinases in human liver. Toxicological sciences : an official journal of the Society of Toxicology 20111201
Management and follow-up of thyroid cancer in pregnant women. Acta otorhinolaryngologica Italica : organo ufficiale della Societa italiana di otorinolaringologia e chirurgia cervico-facciale 20111201
Deiodinases: the balance of thyroid hormone: local impact of thyroid hormone inactivation. The Journal of endocrinology 20110601
Analysis of thyroid hormones in raw and treated waste water. Journal of chromatography. A 20101015
Analysis of thyroid hormones in serum by liquid chromatography-tandem mass spectrometry. Analytical and bioanalytical chemistry 20100701
Effects of substitution and high-dose thyroid hormone therapy on deiodination, sulfoconjugation, and tissue thyroid hormone levels in prolonged critically ill rabbits. Endocrinology 20080801
Iodothyronine deiodinase enzyme activities in bone. Bone 20080701
Metabolic effects of thyroid hormone derivatives. Thyroid : official journal of the American Thyroid Association 20080201
Thyroid hormone transport by the human monocarboxylate transporter 8 and its rate-limiting role in intracellular metabolism. Molecular endocrinology (Baltimore, Md.) 20061101
Differentiation of diiodothyronines using electrospray ionization tandem mass spectrometry. Journal of mass spectrometry : JMS 20060201
Increased thyroxine sulfate levels in critically ill patients as a result of a decreased hepatic type I deiodinase activity. The Journal of clinical endocrinology and metabolism 20051201
Biochemical mechanisms of thyroid hormone deiodination. Thyroid : official journal of the American Thyroid Association 20050801
Human thyroid phenol sulfotransferase enzymes 1A1 and 1A3: activities in normal and diseased thyroid glands, and inhibition by thyroid hormones and phytoestrogens. The Journal of clinical endocrinology and metabolism 20041101
Characteristics and thyroid state-dependent regulation of iodothyronine deiodinases in pigs. Endocrinology 20040901
A radioimmunoassay for measurement of 3,3'-diiodothyronine sulfate: Studies in thyroidal and nonthyroidal diseases, pregnancy, and fetal/neonatal life. Metabolism: clinical and experimental 20040401
Identification of monocarboxylate transporter 8 as a specific thyroid hormone transporter. The Journal of biological chemistry 20031010
Comparative evaluation of 11 scoring functions for molecular docking. Journal of medicinal chemistry 20030605
Thyroid hormone transport by the rat fatty acid translocase. Endocrinology 20030401
Concentrations of seven iodothyronine metabolites in brain regions and the liver of the adult rat. Endocrinology 20020501
Uptake of triiodothyronine and triiodothyroacetic acid in neonatal rat cardiomyocytes: effects of metabolites and analogs. The Journal of endocrinology 20020501
Characterization of human liver thermostable phenol sulfotransferase (SULT1A1) allozymes with 3,3',5-triiodothyronine as the substrate. The Journal of endocrinology 20011201
Thyroid hormone transport by the heterodimeric human system L amino acid transporter. Endocrinology 20011001
Molecular cloning, expression, and characterization of a canine sulfotransferase that is a human ST1B2 ortholog. Archives of biochemistry and biophysics 20010601
Evidence for a role of the type III-iodothyronine deiodinase in the regulation of 3,5,3'-triiodothyronine content in the human central nervous system. European journal of endocrinology 20010601
Sulfation of thyroid hormone and dopamine during human development: ontogeny of phenol sulfotransferases and arylsulfatase in liver, lung, and brain. The Journal of clinical endocrinology and metabolism 20010601

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