Iopanoic acid
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Identification
- Generic Name
- Iopanoic acid
- DrugBank Accession Number
- DB08946
- Background
Iopanoic acid contains iodine and is useful as a contrast medium in cholecystography.
- Type
- Small Molecule
- Groups
- Approved, Withdrawn
- Structure
- Weight
- Average: 570.9319
Monoisotopic: 570.800208893 - Chemical Formula
- C11H12I3NO2
- Synonyms
- Acidum iopanoicum
- Iodopanoic acid
- Iopanoic acid
Pharmacology
- Indication
Not Available
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- Pharmacodynamics
Not Available
- Mechanism of action
- Not Available
- Absorption
Not Available
- Volume of distribution
Not Available
- Protein binding
Not Available
- Metabolism
- Not Available
- Route of elimination
Not Available
- Half-life
Not Available
- Clearance
Not Available
- Adverse Effects
- Improve decision support & research outcomesWith structured adverse effects data, including: blackbox warnings, adverse reactions, warning & precautions, & incidence rates. View sample adverse effects data in our new Data Library!Improve decision support & research outcomes with our structured adverse effects data.
- Toxicity
Not Available
- Pathways
- Not Available
- Pharmacogenomic Effects/ADRs
- Not Available
Interactions
- Drug Interactions
- This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.Not Available
- Food Interactions
- Not Available
Products
- Drug product information from 10+ global regionsOur datasets provide approved product information including:dosage, form, labeller, route of administration, and marketing period.Access drug product information from over 10 global regions.
- International/Other Brands
- Colegraf (Estedi)
- Brand Name Prescription Products
Name Dosage Strength Route Labeller Marketing Start Marketing End Region Image Telepaque - Tablet - 500mg Tablet 500 mg Oral Nycomed Imaging A.S. 1999-06-01 2002-06-19 Canada Telepaque Tab Tablet 500 mg / tab Oral Sterling Winthrop Inc. 1992-12-31 1996-09-10 Canada Telepaque Tab 500mg Tablet 500 mg / tab Oral Sanofi 1952-12-31 1997-07-30 Canada
Categories
- ATC Codes
- V08AC06 — Iopanoic acid
- Drug Categories
- Chemical TaxonomyProvided by Classyfire
- Description
- This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.
- Kingdom
- Organic compounds
- Super Class
- Phenylpropanoids and polyketides
- Class
- Phenylpropanoic acids
- Sub Class
- Not Available
- Direct Parent
- Phenylpropanoic acids
- Alternative Parents
- Aniline and substituted anilines / Iodobenzenes / Aryl iodides / Amino acids / Monocarboxylic acids and derivatives / Carboxylic acids / Primary amines / Organopnictogen compounds / Organoiodides / Organic oxides show 2 more
- Substituents
- 3-phenylpropanoic-acid / Amine / Amino acid / Amino acid or derivatives / Aniline or substituted anilines / Aromatic homomonocyclic compound / Aryl halide / Aryl iodide / Benzenoid / Carbonyl group show 16 more
- Molecular Framework
- Aromatic homomonocyclic compounds
- External Descriptors
- monocarboxylic acid (CHEBI:5951)
- Affected organisms
- Not Available
Chemical Identifiers
- UNII
- FE9794P71J
- CAS number
- 96-83-3
- InChI Key
- OIRFJRBSRORBCM-UHFFFAOYSA-N
- InChI
- InChI=1S/C11H12I3NO2/c1-2-5(11(16)17)3-6-7(12)4-8(13)10(15)9(6)14/h4-5H,2-3,15H2,1H3,(H,16,17)
- IUPAC Name
- 2-[(3-amino-2,4,6-triiodophenyl)methyl]butanoic acid
- SMILES
- CCC(CC1=C(I)C(N)=C(I)C=C1I)C(O)=O
References
- General References
- Renko K, Hoefig CS, Hiller F, Schomburg L, Kohrle J: Identification of iopanoic acid as substrate of type 1 deiodinase by a novel nonradioactive iodide-release assay. Endocrinology. 2012 May;153(5):2506-13. doi: 10.1210/en.2011-1863. Epub 2012 Mar 20. [Article]
- External Links
Clinical Trials
Pharmacoeconomics
- Manufacturers
- Not Available
- Packagers
- Not Available
- Dosage Forms
Form Route Strength Tablet Oral Tablet Oral 500 mg Tablet Oral 500 mg / tab - Prices
- Not Available
- Patents
- Not Available
Properties
- State
- Solid
- Experimental Properties
- Not Available
- Predicted Properties
Property Value Source Water Solubility 0.0138 mg/mL ALOGPS logP 3.93 ALOGPS logP 4.58 Chemaxon logS -4.6 ALOGPS pKa (Strongest Acidic) 2.85 Chemaxon pKa (Strongest Basic) 1.76 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 3 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 63.32 Å2 Chemaxon Rotatable Bond Count 4 Chemaxon Refractivity 95.93 m3·mol-1 Chemaxon Polarizability 36.91 Å3 Chemaxon Number of Rings 1 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon - Predicted ADMET Features
- Not Available
Spectra
- Mass Spec (NIST)
- Not Available
- Spectra
- Chromatographic Properties
Collision Cross Sections (CCS)
Adduct CCS Value (Å2) Source type Source [M-H]- 181.91154 predictedDeepCCS 1.0 (2019) [M+H]+ 184.26955 predictedDeepCCS 1.0 (2019) [M+Na]+ 190.66008 predictedDeepCCS 1.0 (2019)
Drug created at May 27, 2014 16:27 / Updated at February 21, 2021 18:52