CHEBI:31707 - Iodoxamic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Iodoxamic acid
ChEBI ID CHEBI:31707
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C26H26I6N2O10
C26H26I6N2O10
Net Charge 0
Average Mass 1287.920
Monoisotopic Mass 1287.58557
InChI InChI=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)
InChIKey WWVAPFRKZMUPHZ-UHFFFAOYSA-N
SMILES N(C(CCOCCOCCOCCOCCC(NC1=C(I)C(C(O)=O)=C(C=C1I)I)=O)=O)C2=C(I)C(C(O)=O)=C(C=C2I)I
ChEBI Ontology
Outgoing Iodoxamic acid (CHEBI:31707) is a organic molecular entity (CHEBI:50860)
Synonyms Sources
iodoxamate DrugCentral
iodoxamate meglumine DrugCentral
Iodoxamic acid KEGG COMPOUND
iodoxamic acid meglumine salt DrugCentral
Manual Xrefs Databases
3966 DrugCentral
D01312 KEGG DRUG
View more database links
Registry Numbers Types Sources
31127-82-9 CAS Registry Number KEGG COMPOUND
51764-33-1 CAS Registry Number DrugCentral
Last Modified
22 February 2017