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CHEBI:141062 - diodone

ChEBI IDCHEBI:141062
ChEBI Namediodone
Stars
DefinitionA 4-pyridone in which the pyridone is iodo-substituted at C-3 and -5 and has a carboxymethyl substituent on nitrogen; used as a radiocontrast agent urography.
Last Modified19 June 2018
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC7H5I2NO3
Net Charge0
Average Mass404.929
Monoisotopic Mass404.83589
SMILESO=C(O)Cn1cc(I)c(=O)c(I)c1
InChIInChI=1S/C7H5I2NO3/c8-4-1-10(3-6(11)12)2-5(9)7(4)13/h1-2H,3H2,(H,11,12)
InChIKeyPVBALTLWZVEAIO-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Application:
radioopaque medium  A substance having the property of absorbing, and therefore being opaque to, electromagnetic radiation, particularly X-rays.
ChEBI Ontology
Outgoing Relation(s)
diodone (CHEBI:141062) has role radioopaque medium (CHEBI:37338)
diodone (CHEBI:141062) is a 4-pyridones (CHEBI:20485)
diodone (CHEBI:141062) is a monocarboxylic acid (CHEBI:25384)
diodone (CHEBI:141062) is a organoiodine compound (CHEBI:37142)
IUPAC Name 
(3,5-diiodo-4-oxopiperidin-1-yl)acetic acid
Synonyms  Source
umbradilic acidChemIDplus
pelvirinic acidChemIDplus
Diodone acidChemIDplus
3,5-diiodo-4-pyridone-1-acetic acidChEBI
Manual XrefsDatabases
DiodoneWikipedia
US6465174Patent
Registry NumbersSources
Reaxys:163586Reaxys
CAS:101-29-1ChemIDplus
Citations