CHEBI:31176 - adipiodone

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ChEBI Name adipiodone
ChEBI ID CHEBI:31176
Definition An organoiodine compound that is 3-amino-2,4,6-triiodobenzoic acid in which one of the amino hydrogens is substituted by a 6-(3-carboxy-2,4,6-triiodoanilino)-6-oxohexanoyl group. It is a water-soluble radiographic contrast media for cholecystography and intravenous cholangiography.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:43294
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Formula C20H14I6N2O6
Net Charge 0
Average Mass 1139.767
Monoisotopic Mass 1139.51201
InChI InChI=1S/C20H14I6N2O6/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/h5-6H,1-4H2,(H,27,29)(H,28,30)(H,31,32)(H,33,34)
InChIKey FFINMCNLQNTKLU-UHFFFAOYSA-N
SMILES C1=C(C(=C(C(=C1I)NC(=O)CCCCC(=O)NC2=C(C=C(C(=C2I)C(O)=O)I)I)I)C(O)=O)I
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Application(s): radioopaque medium
A substance having the property of absorbing, and therefore being opaque to, electromagnetic radiation, particularly X-rays.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing adipiodone (CHEBI:31176) has role radioopaque medium (CHEBI:37338)
adipiodone (CHEBI:31176) is a benzoic acids (CHEBI:22723)
adipiodone (CHEBI:31176) is a organoiodine compound (CHEBI:37142)
adipiodone (CHEBI:31176) is a secondary carboxamide (CHEBI:140325)
adipiodone (CHEBI:31176) is conjugate acid of adipiodone(2−) (CHEBI:145091)
Incoming adipiodone(2−) (CHEBI:145091) is conjugate base of adipiodone (CHEBI:31176)
IUPAC Name
3,3'-[(1,6-dioxohexane-1,6-diyl)diimino]bis(2,4,6-triiodobenzoic acid)
INNs Sources
adipiodona WHO MedNet
adipiodone WHO MedNet
adipiodone WHO MedNet
adipiodonum WHO MedNet
Synonyms Sources
3,3'-(adipoyldiimino)bis(2,4,6-triiodobenzoic acid) DrugBank
adipiodon ChemIDplus
bilignost ChemIDplus
bilignostum WHO MedNet
biligrafin ChemIDplus
biligrafine ChEBI
bilipolinum ChEBI
endocistobil ChEBI
endographin ChEBI
iodipamide WHO MedNet
Brand Names Sources
Cholografin LINCS
Cholospect ChemIDplus
Transbilix ChemIDplus
Manual Xrefs Databases
1455 DrugCentral
Adipiodone Wikipedia
D01774 KEGG DRUG
DB04711 DrugBank
HMDB0015581 HMDB
IDB PDBeChem
LSM-3496 LINCS
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Registry Numbers Types Sources
2230896 Beilstein Registry Number Beilstein
606-17-7 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
13696912 PubMed citation Europe PMC
437434 PubMed citation Europe PMC
4403049 PubMed citation Europe PMC
4406624 PubMed citation Europe PMC
6452104 PubMed citation Europe PMC
678750 PubMed citation Europe PMC
7105412 PubMed citation Europe PMC
Last Modified
10 October 2019