CHEBI:31710 - iomeprol

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ChEBI Name iomeprol
ChEBI ID CHEBI:31710
Definition A benzenedicarboxamide compound having N-substituted carbamoyl groups at the 1- and 3-positions, iodo substituents at the 2-, 4- and 6-positions and a glycoloyl(methyl)amino group at the 5-position.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C17H22I3N3O8
Net Charge 0
Average Mass 777.08530
Monoisotopic Mass 776.85410
InChI InChI=1S/C17H22I3N3O8/c1-23(9(29)6-26)15-13(19)10(16(30)21-2-7(27)4-24)12(18)11(14(15)20)17(31)22-3-8(28)5-25/h7-8,24-28H,2-6H2,1H3,(H,21,30)(H,22,31)
InChIKey NJKDOADNQSYQEV-UHFFFAOYSA-N
SMILES CN(C(=O)CO)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I
Roles Classification
Chemical Role(s): environmental contaminant
Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Role(s): xenobiotic
A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
Application(s): radioopaque medium
A substance having the property of absorbing, and therefore being opaque to, electromagnetic radiation, particularly X-rays.
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ChEBI Ontology
Outgoing iomeprol (CHEBI:31710) has role environmental contaminant (CHEBI:78298)
iomeprol (CHEBI:31710) has role radioopaque medium (CHEBI:37338)
iomeprol (CHEBI:31710) has role xenobiotic (CHEBI:35703)
iomeprol (CHEBI:31710) is a benzenedicarboxamide (CHEBI:38800)
iomeprol (CHEBI:31710) is a organoiodine compound (CHEBI:37142)
IUPAC Name
N,N'-bis(2,3-dihydroxypropyl)-5-[glycoloyl(methyl)amino]-2,4,6-triiodoisophthalamide
INNs Sources
iomeprol KEGG DRUG
iomeprolum ChemIDplus
Synonym Source
N,N'-Bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-(N-methylglycolamido)isophthalamide ChemIDplus
Manual Xrefs Databases
1463 DrugCentral
D01719 KEGG DRUG
Iomeprol Wikipedia
View more database links
Registry Numbers Types Sources
78649-41-9 CAS Registry Number KEGG DRUG
78649-41-9 CAS Registry Number ChemIDplus
8177227 Reaxys Registry Number Reaxys
8177227 Beilstein Registry Number Beilstein
Citation Waiting for Citations Type Source
15206581 PubMed citation Europe PMC
Last Modified
22 February 2017