CHEBI:31710 - iomeprol

ChEBI IDCHEBI:31710
ChEBI Nameiomeprol
Stars
DefinitionA 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.
Last Modified22 February 2017
DownloadsMolfile
FormulaC17H22I3N3O8
Net Charge0
Average Mass777.088
Monoisotopic Mass776.85411
SMILESCN(C(=O)CO)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I
InChIInChI=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)
InChIKeyNJKDOADNQSYQEV-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Role:
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:
radioopaque medium  A substance having the property of absorbing, and therefore being opaque to, electromagnetic radiation, particularly X-rays.
ChEBI Ontology
Outgoing Relation(s)
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  Source
iomeprolKEGG DRUG
iomeprolumChemIDplus
Synonym  Source
N,N'-Bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-(N-methylglycolamido)isophthalamideChemIDplus
Manual XrefsDatabases
1463DrugCentral
D01719KEGG DRUG
IomeprolWikipedia
Registry NumbersSources
Reaxys:8177227Reaxys
CAS:78649-41-9ChemIDplus
CAS:78649-41-9KEGG DRUG
Citations