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Basic information
- Standard SMILES
CNC(=O)c1c(I)c(NC(C)=O)c(I)c(C(=O)O)c1I.CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO- InChIKey
VLHUSFYMPUDOEL-WZTVWXICSA-N- Molecular formula
- C18H26I3N3O9
- Average molar mass
- 809.13 g/mol
- Monoisotopic mass
- 808.88032341
Names & identifiers
- Preferred name
- 5-Acetamido-2,4,6-triiodo-N-methylisophthalamic acid-methylglucamine
- IUPAC
- 3-Acetamido-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid--1-deoxy-1-(methylamino)-D-glucitol (1/1)
Database identifiers
- CAS
13087-53-1- PubChem CID
- 656642
- DTXSID
DTXSID10926949- ChEMBL
CHEMBL1201125- ChEBI
CHEBI:31714- UNII
- XUW72GOP7W
- EC Number
- 235-998-9
Related reactions
0 records
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Linked notes
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