Tiratricol

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Systematic / IUPAC Name: [4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic acid

ID: Reference3016

Other Names: Tiratricolum ;
Triac;
[4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic acid ;
2-[4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic acid;
3,3′,5-Triiodothyroacetic acid ; more

Formula: C14H9I3O4

Class: Endogenous Metabolites Therapeutics/Prescription Drugs

Spectral Data

Tiratricol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 156
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 9/22/2015 1:40:36 PM
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Identificators

InChI InChI=1S/C14H9I3O4/c15-9-6-8(1-2-12(9)18)21-14-10(16)3-7(4-11(14)17)5-13(19)20/h1-4,6,18H,5H2,(H,19,20)
InChI Key UOWZUVNAGUAEQC-UHFFFAOYSA-N
Canonical SMILES C1=CC(=C(C=C1OC2=C(C=C(C=C2I)CC(=O)O)I)I)O
CAS 51241
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Other Names Tiratricolum ;
Triac;
[4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic acid ;
2-[4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic acid;
3,3′,5-Triiodothyroacetic acid ;
4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodobenzeneacetic acid;
4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodophenylacetic acid;
Triiodothyroacetic acid

In Other Databases

ChEMBL CHEMBL41632
KEGG D07214
DrugBank DB03604
Wikipedia Tiratricol
ChemIDPlus 000051241; 100216566; 001052922; 001477049; 040993155; 023284277
ChemSpider 5598
PubChem 5803