2-[[(2s)-1-acetylpyrrolidine-2-carbonyl]-nitrosoamino]acetic acid (CED0315037)

Record Information
Version1.0
Creation Date2026-09-01 15:30:17 UTC
Update Date2026-09-01 15:30:17 UTC
Accession NumberCHEM360970
Identification
Common Name2-[[(2s)-1-acetylpyrrolidine-2-carbonyl]-nitrosoamino]acetic acid
ClassSmall Molecule
Description
2-[[(2s)-1-acetylpyrrolidine-2-carbonyl]-nitrosoamino]acetic acid is a chemical compound with the formula C9H13N3O5 and an average molecular weight of 243.22 g/mol. This substance has been identified in or released from two recorded sources, specifically electrical and electronic equipment including video games and television systems.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC9H13N3O5
Average Molecular MassNot Available
Monoisotopic Mass243.086 g/mol
CAS Registry NumberNot Available
IUPAC NameNot Available
Traditional NameNot Available
SMILESCC(=O)N1CCCC1C(=O)N(CC(=O)O)N=O
InChI IdentifierInChI=1S/C9H13N3O5/c1-6(13)11-4-2-3-7(11)9(16)12(10-17)5-8(14)15/h7H,2-5H2,1H3,(H,14,15)/t7-/m0/s1
InChI KeyHWWIYXKSCZCMFV-ZETCQYMHSA-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
2297.0Log mg/kg[1300:4100]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
537Television SystemsElectrical & Electronic EquipmentNot Available
539Video GamesElectrical & Electronic EquipmentNot 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)3.65891
Angiotensin-converting enzyme structureClick to view 3D structureAngiotensin-converting enzymeP12821HumansPredicted (SEA)123.313
Click to view 3D structureAngiotensin-converting enzymeP47820Rattus norvegicusPredicted (SEA)60.3331
Click to view 3D structureAngiotensin-converting enzymeP12822Oryctolagus cuniculusPredicted (SEA)76.2144
Diphosphomevalonate decarboxylase structureClick to view 3D structureDiphosphomevalonate decarboxylaseP53602HumansPredicted (SEA)1.94623
Click to view 3D structureXaa-Pro aminopeptidase 2O43895HumansPredicted (SEA)36.5891
Xaa-Pro dipeptidase structureClick to view 3D structureXaa-Pro dipeptidaseP12955HumansPredicted (SEA)52.159
Prolyl endopeptidase structureClick to view 3D structureProlyl endopeptidaseP48147HumansPredicted (SEA)42.4278
Dipeptidyl peptidase 4 structureClick to view 3D structureDipeptidyl peptidase 4P27487HumansPredicted (SEA)109.767
Click to view 3D structureProlyl endopeptidaseP23687Sus scrofaPredicted (SEA)53.0932
Legumain structureClick to view 3D structureLegumainQ99538HumansPredicted (SEA)20.7857
Prothrombin structureClick to view 3D structureProthrombinP00734HumansPredicted (SEA)686.163
Click to view 3D structureMu-type opioid receptorP33535Rattus norvegicusPredicted (SEA)517.619
Click to view 3D structureProlyl endopeptidaseQ9XTA2Bos taurusPredicted (SEA)36.9784
Click to view 3D structureDelta-type opioid receptorP32300Mus musculusPredicted (SEA)412.367
Click to view 3D structureXaa-Pro aminopeptidase 2Q99MA2Rattus norvegicusPredicted (SEA)59.399
Click to view 3D structureProlyl endopeptidaseP27028Elizabethkingia meningosepticaPredicted (SEA)42.4278
Xaa-Pro aminopeptidase 1 structureClick to view 3D structureXaa-Pro aminopeptidase 1Q9NQW7HumansPredicted (SEA)79.4841
Click to view 3D structureMu-type opioid receptorP97266Cavia porcellusPredicted (SEA)479.084
Click to view 3D structureDelta-type opioid receptorP33533Rattus norvegicusPredicted (SEA)494.498
Serine protease 1 structureClick to view 3D structureSerine protease 1P07477HumansPredicted (SEA)376.245
Mu-type opioid receptor structureClick to view 3D structureMu-type opioid receptorP35372HumansPredicted (SEA)1368.2
Prolyl endopeptidase FAP structureClick to view 3D structureProlyl endopeptidase FAPQ12884HumansPredicted (SEA)60.411
Click to view 3D structureNeprilysinP08049Oryctolagus cuniculusPredicted (SEA)251.219
Click to view 3D structureCytosol aminopeptidaseP28838HumansPredicted (SEA)178.82
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available