diatrizoate sodium i 131 (CHEBI:751878)

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CHEBI:751878 - diatrizoate sodium i 131

Formula	Na.C11H8N2O4
Net Charge	0
Average Mass	647.903
Monoisotopic Mass	647.75655
SMILES	CC(=O)Nc1c([131I])c(NC(C)=O)c([131I])c(C(=O)[O-])c1[131I].[Na+]
InChI	InChI=1S/C11H9I3N2O4.Na/c1-3(17)15-9-6(12)5(11(19)20)7(13)10(8(9)14)16-4(2)18;/h1-2H3,(H,15,17)(H,16,18)(H,19,20);/q;+1/p-1/i12+4,13+4,14+4;
InChIKey	ZEYOIOAKZLALAP-KYJPGBFZSA-M

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	diatrizoate sodium i 131 (CHEBI:751878) is a amidobenzoic acid (CHEBI:48470)

Synonyms	Source
Diatrizoate sodium i 131	ChEMBL
Diatrizoate sodium i-131	ChEMBL