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CHEBI:34521 - Acetrizoic acid

ChEBI IDCHEBI:34521
ChEBI NameAcetrizoic acid
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC9H6I3NO3
Net Charge0
Average Mass556.863
Monoisotopic Mass556.74819
SMILESCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I
InChIInChI=1S/C9H6I3NO3/c1-3(14)13-8-5(11)2-4(10)6(7(8)12)9(15)16/h2H,1H3,(H,13,14)(H,15,16)
InChIKeyGNOGSFBXBWBTIG-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Acetrizoic acid (CHEBI:34521) is a aminobenzoic acid (CHEBI:22495)
Synonyms  Source
Acetrizoic acidKEGG COMPOUND
sodium acetrizoateDrugCentral
urokonic acidDrugCentral
urokonDrugCentral
acetrizoate sodiumDrugCentral
opacaronDrugCentral
Manual XrefsDatabases
C14164KEGG COMPOUND
D02457KEGG DRUG
63DrugCentral
Registry NumbersSources
CAS:85-36-9KEGG COMPOUND