EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:31704 - iodipamide dimeglumine

Default Structure
ChEBI IDCHEBI:31704
ChEBI Nameiodipamide dimeglumine
Stars
DefinitionAn organoammonium salt obtained by reaction of adipiodone with two equivalents of 1-deoxy-1-(methylamino)-D-glucitol. It is a contrast agent used in diagnostic imaging.
Last Modified10 October 2019
DownloadsMolfile
FormulaC20H12I6N2O6.2C7H18NO5
Net Charge0
Average Mass1530.194
Monoisotopic Mass1529.73337
SMILESC[NH2+]C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.C[NH2+]C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)[O-])c1I)Nc1c(I)cc(I)c(C(=O)[O-])c1I
InChIInChI=1S/C20H14I6N2O6.2C7H17NO5/c21-7-5-9(23)17(15(25)13(7)19(31)32)27-11(29)3-1-2-4-12(30)28-18-10(24)6-8(22)14(16(18)26)20(33)34;2*1-8-2-4(10)6(12)7(13)5(11)3-9/h5-6H,1-4H2,(H,27,29)(H,28,30)(H,31,32)(H,33,34);2*4-13H,2-3H2,1H3/t;2*4-,5+,6+,7+/m.00/s1
InChIKeyDGIAUNUPXILTJW-VRWDCWMNSA-N
Roles Classification
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)
iodipamide dimeglumine (CHEBI:31704) has part adipiodone(2−) (CHEBI:145091)
iodipamide dimeglumine (CHEBI:31704) has role radioopaque medium (CHEBI:37338)
iodipamide dimeglumine (CHEBI:31704) is a organoammonium salt (CHEBI:46850)
IUPAC Name 
bis[1-deoxy-1-(methylazaniumyl)-D-glucitol] 3,3'-[(1,6-dioxohexane-1,6-diyl)diimino]bis(2,4,6-triiodobenzoate)
Synonyms  Source
adipiodone meglumineDrugBank
adipiodone meglumine injectionChemIDplus
iodipamide meglumineKEGG DRUG
iodipamide meglumineChemIDplus
iodipamide meglumine saltChemIDplus
iodipamide methylglucamine saltChemIDplus
Brand Names  Source
Biligrafin forteChemIDplus
CavumbrenChemIDplus
CavumbrenChEBI
Cholografin meglumineKEGG DRUG
EndocistobilChemIDplus
EndografinChemIDplus
Manual XrefsDatabases
D01916KEGG DRUG
DBSALT001312DrugBank
Registry NumbersSources
CAS:3521-84-4ChemIDplus
CAS:3521-84-4KEGG COMPOUND
Citations