Ioglicic Acid
Basic information
- CAS
49755-67-1- Standard SMILES
CNC(=O)CNC(=O)c1c(I)c(NC(C)=O)c(I)c(C(=O)O)c1I- InChIKey
HHFIATHHSBFCBY-UHFFFAOYSA-N- Molecular formula
- C13H12I3N3O5
- Average molar mass
- 670.96 g/mol
- Monoisotopic mass
- 670.7911
Overview
Ioglicic acid is an amidobenzoic acid.
Names & identifiers
- Preferred name
- Ioglicic Acid
- IUPAC
- 3-acetamido-2,4,6-triiodo-5-[[2-(methylamino)-2-oxoethyl]carbamoyl]benzoic acid
- English name
- ioglicic acid
- Molecular formula
- C13H12I3N3O5
- Molecular weight
- 670.96
Names & synonyms
Ioglicic acid49755-67-1Acido ioglicicoAcide iogliciqueAcidum ioglicicumSH H 200 ABSH-H-200-AB3LGR5S8101DTXSID10198023RefChem:923517DTXCID40120514V08AA06
Show more names
RayvistLoglicicSH-H-200ABLoglicic acid3-(Acetylamino)-2,4,6-triiodo-5-[[[2-(methylamino)-2-oxoethyl]amino]carbonyl]benzoic acidBenzoic acid, 3-(acetylamino)-2,4,6-triiodo-5-[[[2-(methylamino)-2-oxoethyl]amino]carbonyl]-
3-acetamido-2,4,6-triiodo-5-(((methylcarbamoyl)methyl)carbamoyl)benzoic acid256-470-43-(acetylamino)-2,4,6-triiodo-5-(((2-(methylamino)-2-oxo ethyl)amino)carbonyl)benzoic acid3-acetamido-2,4,6-triiodo-5-[[2-(methylamino)-2-oxoethyl]carbamoyl]benzoic acidBenzoic acid, 3-(acetylamino)-2,4,6-triiodo-5-(((2-(methylamino)-2-oxoethyl)amino)carbonyl)-5-Acetamido-2,4,6-triiodo-N-((methylcarbamoyl)methyl)isophthalamic acidUNII-3LGR5S8101Acide ioglicique [INN-French]
Database identifiers
- CAS
49755-67-1- PubChem CID
- 65437
- DTXSID
DTXSID10198023- ChEMBL
CHEMBL2105024- ChEBI
CHEBI:135999- UNII
- 3LGR5S8101
- EC Number
- 256-470-4
- Nikkaji
- J10.373J
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 533
Physicochemical properties
- FDA UNII
- 3 LGR5S8101 · 3LGR5S8101
- ATC code
- 8 AA06 · V08AA06
Chemistry & industry
Pharmacology
ATC Code
V - Various
QV - Various
Applications
UsesDiagnostic aid (radiopaque medium).
Additional notes
DefinitionChEBI: Ioglicic acid is an amidobenzoic acid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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