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CHEBI:31707 - Iodoxamic acid

Default Structure
ChEBI IDCHEBI:31707
ChEBI NameIodoxamic acid
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC26H26I6N2O10
Net Charge0
Average Mass1287.922
Monoisotopic Mass1287.58558
SMILESO=C(CCOCCOCCOCCOCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc1c(I)cc(I)c(C(=O)O)c1I
InChIInChI=1S/C26H26I6N2O10/c27-13-11-15(29)23(21(31)19(13)25(37)38)33-17(35)1-3-41-5-7-43-9-10-44-8-6-42-4-2-18(36)34-24-16(30)12-14(28)20(22(24)32)26(39)40/h11-12H,1-10H2,(H,33,35)(H,34,36)(H,37,38)(H,39,40)
InChIKeyWWVAPFRKZMUPHZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Iodoxamic acid (CHEBI:31707) is a organic molecular entity (CHEBI:50860)
Synonyms  Source
iodoxamateDrugCentral
iodoxamate meglumineDrugCentral
Iodoxamic acidKEGG COMPOUND
iodoxamic acid meglumine saltDrugCentral
Manual XrefsDatabases
3966DrugCentral
D01312KEGG DRUG
Registry NumbersSources
CAS:31127-82-9KEGG COMPOUND
CAS:51764-33-1DrugCentral