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CHEBI:63578 - iopromide

ChEBI IDCHEBI:63578
ChEBI Nameiopromide
Stars
DefinitionA dicarboxylic acid diamide that consists of N-methylisophthalamide bearing three iodo substituents at positions 2, 4 and 6, a methoxyacetyl substituent at position 5 and two 2,3-dihydroxypropyl groups attached to the amide nitrogens. A water soluble x-ray contrast agent for intravascular administration.
Secondary ChEBI IDCHEBI:31712
Last Modified22 February 2017
DownloadsMolfile
FormulaC18H24I3N3O8
Net Charge0
Average Mass791.115
Monoisotopic Mass790.86976
SMILESCOCC(=O)Nc1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)N(C)CC(O)CO)c1I
InChIInChI=1S/C18H24I3N3O8/c1-24(4-9(28)6-26)18(31)12-13(19)11(17(30)22-3-8(27)5-25)14(20)16(15(12)21)23-10(29)7-32-2/h8-9,25-28H,3-7H2,1-2H3,(H,22,30)(H,23,29)
InChIKeyDGAIEPBNLOQYER-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Roles:
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.
nephrotoxic agent  A role played by any chemical compound (natural or synthetic) exhibiting itself through the ability to induce damage to the kidneys.
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)
iopromide (CHEBI:63578) has functional parent glycerol (CHEBI:17754)
iopromide (CHEBI:63578) has functional parent isophthalamide (CHEBI:38801)
iopromide (CHEBI:63578) has role environmental contaminant (CHEBI:78298)
iopromide (CHEBI:63578) has role nephrotoxic agent (CHEBI:50909)
iopromide (CHEBI:63578) has role radioopaque medium (CHEBI:37338)
iopromide (CHEBI:63578) has role xenobiotic (CHEBI:35703)
iopromide (CHEBI:63578) is a dicarboxylic acid diamide (CHEBI:35779)
iopromide (CHEBI:63578) is a organoiodine compound (CHEBI:37142)
IUPAC Name 
N,N'-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-[(methoxyacetyl)amino]-N-methylisophthalamide
INNs  Source
iopromideKEGG DRUG
iopromidaChemIDplus
iopromidumChemIDplus
Synonym  Source
N,N'-Bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-(2-methoxyacetamido)-N-methylisophthalamideChemIDplus
Brand Name  Source
UltravistKEGG DRUG
Manual XrefsDatabases
D01893KEGG DRUG
DE2909439Patent
US4364921Patent
IopromideWikipedia
HMDB0041910HMDB
LSM-5134LINCS
1468DrugCentral
Registry NumbersSources
Reaxys:7085608Reaxys
CAS:73334-07-3ChemIDplus
Citations