1-(1-L-alanyl-L-prolyl)-L-proline (CED0192081)

Record Information
Version1.0
Creation Date2026-04-04 23:50:46 UTC
Update Date2026-04-04 23:50:46 UTC
Accession NumberCHEM085492
Identification
Common Name1-(1-L-alanyl-L-prolyl)-L-proline
ClassSmall Molecule
Description
1-(1-L-alanyl-L-prolyl)-L-proline is an organic compound with the chemical formula C13H21N3O4 and an average molecular weight of 283.33 g/mol. 1-(1-L-alanyl-L-prolyl)-L-proline belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. This substance is found in or released from three recorded sources. These sources include food, food processing, and cookware, specifically in the preparation of wort, as well as electrical and electronic equipment, including antennas and amplifiers.
Contaminant TypeNot Available
Chemical Structure
SynonymsNot Available
Chemical FormulaC13H21N3O4
Average Molecular Mass283.328 g/mol
Monoisotopic Mass283.153 g/mol
CAS Registry Number22049-75-8
IUPAC NameNot Available
Traditional NameNot Available
SMILESCC(N)C(=O)N1CCCC1C(=O)N1CCCC1C(O)=O
InChI IdentifierInChI=1/C13H21N3O4/c1-8(14)11(17)15-6-2-4-9(15)12(18)16-7-3-5-10(16)13(19)20/h8-10H,2-7,14H2,1H3,(H,19,20)
InChI KeyOLVCTPPSXNRGKV-GUBZILKMSA-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
1535.0Log mg/kg[860:2700]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
505AmplifiersElectrical & Electronic EquipmentNot Available
506AntennasElectrical & Electronic EquipmentNot Available
550Preparation Of WortFood, food processing & cookwareNot Available
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Click to view 3D structureIgA-specific serine endopeptidase autotransporterP09790Neisseria gonorrhoeaePredicted (SEA)0.155698
Angiotensin-converting enzyme structureClick to view 3D structureAngiotensin-converting enzymeP12821HumansPredicted (SEA)4.67095
Click to view 3D structureAngiotensin-converting enzymeP12822Oryctolagus cuniculusPredicted (SEA)3.97031
Click to view 3D structureAngiotensin-converting enzymeP47820Rattus norvegicusPredicted (SEA)2.64687
Click to view 3D structureXaa-Pro aminopeptidase 2O43895HumansPredicted (SEA)0.700643
Xaa-Pro dipeptidase structureClick to view 3D structureXaa-Pro dipeptidaseP12955HumansPredicted (SEA)3.03612
Click to view 3D structureCytosol aminopeptidaseP28838HumansPredicted (SEA)4.12601
Click to view 3D structureXaa-Pro aminopeptidase 2Q99MA2Rattus norvegicusPredicted (SEA)2.56902
Click to view 3D structureSuccinyl-diaminopimelate desuccinylaseP44514Haemophilus influenzae (strain ATCC 51907 / DSM 11121 / KW20 / Rd)Predicted (SEA)0.233548
Dipeptidyl peptidase 4 structureClick to view 3D structureDipeptidyl peptidase 4P27487HumansPredicted (SEA)24.289
Xaa-Pro aminopeptidase 1 structureClick to view 3D structureXaa-Pro aminopeptidase 1Q9NQW7HumansPredicted (SEA)9.10836
Click to view 3D structureNeprilysinP08049Oryctolagus cuniculusPredicted (SEA)25.3788
Prothrombin structureClick to view 3D structureProthrombinP00734HumansPredicted (SEA)121.523
Diphosphomevalonate decarboxylase structureClick to view 3D structureDiphosphomevalonate decarboxylaseP53602HumansPredicted (SEA)0.467095
Dipeptidyl peptidase 8 structureClick to view 3D structureDipeptidyl peptidase 8Q6V1X1HumansPredicted (SEA)14.9471
Dipeptidyl peptidase 2 structureClick to view 3D structureDipeptidyl peptidase 2Q9UHL4HumansPredicted (SEA)11.5217
Renin structureClick to view 3D structureReninP00797HumansPredicted (SEA)55.6622
Prolyl endopeptidase FAP structureClick to view 3D structureProlyl endopeptidase FAPQ12884HumansPredicted (SEA)15.8034
Dipeptidyl peptidase 9 structureClick to view 3D structureDipeptidyl peptidase 9Q86TI2HumansPredicted (SEA)17.5161
Prolyl endopeptidase structureClick to view 3D structureProlyl endopeptidaseP48147HumansPredicted (SEA)11.7552
Click to view 3D structureMu-type opioid receptorP33535Rattus norvegicusPredicted (SEA)278.0
Click to view 3D structureDelta-type opioid receptorP33533Rattus norvegicusPredicted (SEA)245.225
Click to view 3D structureProlyl endopeptidaseP27028Elizabethkingia meningosepticaPredicted (SEA)8.95266
Click to view 3D structureSubstance-P receptorP14600Rattus norvegicusPredicted (SEA)138.338
Click to view 3D structureProlyl endopeptidaseP23687Sus scrofaPredicted (SEA)12.4559
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available