Iolidonic acid (CED0000106)

Record Information
Version1.0
Creation Date2026-04-06 12:19:38 UTC
Update Date2026-08-19 10:18:25 UTC
Accession NumberCHEM124280
Identification
Common NameIolidonic acid
ClassSmall Molecule
Description
Iolidonic acid belongs to the phenylpyrrolidines, a subclass of pyrrolidines within the organic compounds. It is classified as an organoheterocyclic compound with the formula C15H16I3N1O3. With an average molecular weight of 639.01 g/mol, Iolidonic acid is a heavy molecule.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC15H16I3N1O3
Average Molecular Mass639.010 g/mol
Monoisotopic Mass638.826 g/mol
CAS Registry Number21766-53-0
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C15H16I3NO3/c1-2-8(15(21)22)6-9-10(16)7-11(17)14(13(9)18)19-5-3-4-12(19)20/h7-8H,2-6H2,1H3,(H,21,22)
InChI KeyMJGWMPWEXXUAPD-UHFFFAOYSA-N
Chemical Taxonomy
ClassificationNot classified
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Organoleptic EffectsNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
SpectraNot Available
Toxicity Profile
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Toxicity Values
Toxicity ValueUnitValue RangeOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalReference
5853.0Log mg/kg[3300:10000]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Click to view 3D structureTyrosine 3-monooxygenaseP04177Rattus norvegicusPredicted (SEA)27.7922
Peroxisome proliferator-activated receptor gamma structureClick to view 3D structurePeroxisome proliferator-activated receptor gammaP37231HumansPredicted (SEA)1831.25
Cytochrome P450 3A4 structureClick to view 3D structureCytochrome P450 3A4P08684HumansPredicted (SEA)6360.9
PC4 and SFRS1-interacting protein structureClick to view 3D structurePC4 and SFRS1-interacting proteinO75475HumansPredicted (SEA)19.0731
Prothrombin structureClick to view 3D structureProthrombinP00734HumansPredicted (SEA)2485.26
Coagulation factor X structureClick to view 3D structureCoagulation factor XP00742HumansPredicted (SEA)2327.3
Click to view 3D structureGlutamate--cysteine ligase catalytic subunitP48506HumansPredicted (SEA)9.26406
Click to view 3D structureMast cell carboxypeptidase AP15088HumansPredicted (SEA)210.349
Peroxisome proliferator-activated receptor alpha structureClick to view 3D structurePeroxisome proliferator-activated receptor alphaQ07869HumansPredicted (SEA)2344.9
Click to view 3D structureSynaptic vesicle glycoprotein 2AQ02563Rattus norvegicusPredicted (SEA)5.60514
Muscarinic acetylcholine receptor M2 structureClick to view 3D structureMuscarinic acetylcholine receptor M2P08172HumansPredicted (SEA)4195.84
Muscarinic acetylcholine receptor M1 structureClick to view 3D structureMuscarinic acetylcholine receptor M1P11229HumansPredicted (SEA)4584.46
Click to view 3D structureSolute carrier organic anion transporter family member 1C1Q9ERB5Mus musculusPredicted (SEA)29.3492
Muscarinic acetylcholine receptor M5 structureClick to view 3D structureMuscarinic acetylcholine receptor M5P08912HumansPredicted (SEA)3785.89
Melanocortin receptor 4 structureClick to view 3D structureMelanocortin receptor 4P32245HumansPredicted (SEA)1728.02
Glutamate receptor 1 structureClick to view 3D structureGlutamate receptor 1P42261HumansPredicted (SEA)163.795
Carboxypeptidase B2 structureClick to view 3D structureCarboxypeptidase B2Q96IY4HumansPredicted (SEA)179.209
Click to view 3D structureGlutamate racemaseQ03469Lactobacillus fermentumPredicted (SEA)221.715
Click to view 3D structureGlutamate receptor 1P19490Rattus norvegicusPredicted (SEA)350.166
Click to view 3D structureGlutamate receptor ionotropic, kainate 1P22756Rattus norvegicusPredicted (SEA)224.984
Click to view 3D structureGlutamate receptor 2P19491Rattus norvegicusPredicted (SEA)69.3637
Click to view 3D structureGlutamate receptor ionotropic, kainate 3P42264Rattus norvegicusPredicted (SEA)104.24
Click to view 3D structureGlutamate receptor 4P19493Rattus norvegicusPredicted (SEA)53.0153
Click to view 3D structureGlutamate receptor 3P19492Rattus norvegicusPredicted (SEA)103.851
Click to view 3D structureMuscarinic acetylcholine receptor M1P08482Rattus norvegicusPredicted (SEA)2312.67
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available