EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:134740 - sodium 2-(131I)iodohippurate

ChEBI IDCHEBI:134740
ChEBI Namesodium 2-(131I)iodohippurate
Stars
ASCII Namesodium 2-((131)I)iodohippurate
Last Modified28 January 2019
DownloadsMolfile
FormulaC9H7NO3.Na
Net Charge0
Average Mass331.055
Monoisotopic Mass330.93849
SMILESO=C([O-])CNC(=O)c1ccccc1[131I].[Na+]
InChIInChI=1S/C9H8INO3.Na/c10-7-4-2-1-3-6(7)9(14)11-5-8(12)13;/h1-4H,5H2,(H,11,14)(H,12,13);/q;+1/p-1/i10+4;
InChIKeyXYITYKDGJLHYPW-UDYUCQKZSA-M
Roles Classification
Applications:
radiopharmaceutical  Any pharmaceutical compound containing a radioisotope.
radioopaque medium  A substance having the property of absorbing, and therefore being opaque to, electromagnetic radiation, particularly X-rays.
ChEBI Ontology
Outgoing Relation(s)
sodium 2-(131I)iodohippurate (CHEBI:134740) has functional parent N-benzoylglycine (CHEBI:18089)
sodium 2-(131I)iodohippurate (CHEBI:134740) has role radiopharmaceutical (CHEBI:35232)
sodium 2-(131I)iodohippurate (CHEBI:134740) is a isotopically modified compound (CHEBI:139358)
sodium 2-(131I)iodohippurate (CHEBI:134740) is a organic sodium salt (CHEBI:38700)
sodium 2-(131I)iodohippurate (CHEBI:134740) is a sodium 2-iodohippurate (CHEBI:140411)
IUPAC Name 
sodium [2-(131I)iodobenzamido]acetate
Synonyms  Source
Hippuran-131DrugCentral
Hippuran I131DrugCentral
iodohippurate sodium I131ChEBI
iodohippurate sodium (131I)ChEBI
Manual XrefsDatabases
4828DrugCentral
Registry NumbersSources
CAS:881-17-4DrugCentral