ioxaglate sodium (CHEBI:749311)

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CHEBI:749311 - ioxaglate sodium

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ChEBI ID	CHEBI:749311
ChEBI Name	ioxaglate sodium
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Last Modified	29 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	Na.C24H20I6N5O8
Net Charge	0
Average Mass	1290.865
Monoisotopic Mass	1290.54779
SMILES	CNC(=O)c1c(I)c(C(=O)NCC(=O)Nc2c(I)c(C(=O)[O-])c(I)c(C(=O)NCCO)c2I)c(I)c(N(C)C(C)=O)c1I.[Na+]
InChI	InChI=1S/C24H21I6N5O8.Na/c1-7(37)35(3)20-17(29)10(21(39)31-2)13(25)11(18(20)30)23(41)33-6-8(38)34-19-15(27)9(22(40)32-4-5-36)14(26)12(16(19)28)24(42)43;/h36H,4-6H2,1-3H3,(H,31,39)(H,32,40)(H,33,41)(H,34,38)(H,42,43);/q;+1/p-1
InChIKey	MBVDCEVFLAONHO-UHFFFAOYSA-M

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	ioxaglate sodium (CHEBI:749311) is a amidobenzoic acid (CHEBI:48470)

Synonym	Source
Sodium ioxaglate	ChEMBL

Brand Name	Source
Ioxaglate sodium component of hexabrix	ChEMBL