[Gly1,D-Asp3]MC-LHar (CED0152234)

Record Information
Version1.0
Creation Date2026-04-06 08:26:38 UTC
Update Date2026-05-21 08:32:59 UTC
SynCED IDCED0152234
Secondary Accession Numbers
  • CHEM120479
Identification
Common Name[Gly1,D-Asp3]MC-LHar
ClassSmall Molecule
Description
[Gly1,D-Asp3]MC-LHar belongs to the hybrid peptides, a subclass of peptidomimetics within the organic compounds. This compound has the chemical formula C48H72N10O12 and is classified as part of the organic acids and derivatives superclass. The compound has been identified in or released from 13 recorded sources across several sectors. Within the electrical and electronic equipment sector, it is found in cell phones, capacitors, wires and cables, batteries, and printed circuit boards, among one other source. In the textiles, leather and furnishings sector, it is associated with synthetic textiles as well as carpets and rugs. It is also recorded in food packaging within the food, food processing and cookware sector. Additionally, the compound is present in medical devices from the healthcare, pharmaceuticals and veterinary products sector. In both the energy, oil and gas sector and the industrial manufacturing and chemical processing sector, it is found in lubricants. It has also been recorded in one other sector. Recorded routes of exposure for [Gly1,D-Asp3]MC-LHar include inhalation, oral, and touch.
Contaminant Type
  • PFAS
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC48H72N10O12
Average Molecular MassNot Available
Monoisotopic Mass980.533 g/mol
CAS Registry NumberNot Available
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C48H72N10O12/c1-27(2)22-36-45(65)57-37(47(68)69)25-39(59)53-34(16-12-13-21-51-48(49)50)44(64)55-33(18-17-28(3)23-29(4)38(70-8)24-32-14-10-9-11-15-32)30(5)42(62)56-35(46(66)67)19-20-41(61)58(7)31(6)43(63)52-26-40(60)54-36/h9-11,14-15,17-18,23,27,29-30,33-38H,6,12-13,16,19-22,24-26H2,1-5,7-8H3,(H,52,63)(H,53,59)(H,54,60)(H,55,64)(H,56,62)(H,57,65)(H,66,67)(H,68,69)(H4,49,50,51)/b18-17+,28-23+/t29-,30-,33-,34-,35+,36-,37+,38-/m0/s1
InChI KeyJSPVTQVNXUVMTI-GYSRTOPMSA-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
Toxicity ValuesNot Available
Toxicity / Toxin ClassNot Available
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Health Effects
Health EffectRelationshipDirectionDescriptionReference
Exposure Sources
Source IDSourceSectorReference
CEDs000007Pesticides?Pesticides are synthetic chemicals designed to prevent, destroy, or control pests that threaten crops and agricultural productivity.Agriculture & land managementNot Available
CEDs000120Wires and cables?Wires and cables are integral components in the transmission of electrical power and signals.Electrical & Electronic EquipmentNot Available
CEDs000121Printed circuit boards?Printed circuit boards (PCBs) are essential components in the manufacturing of electronic devices, serving as the backbone for electrical connections and circuit pathways.Electrical & Electronic EquipmentNot Available
CEDs000125Batteries?Batteries are devices that store and release electrical energy through electrochemical reactions.Electrical & Electronic EquipmentNot Available
CEDs000130Semiconductors?Semiconductors are materials that possess electrical conductivity between that of conductors and insulators, making them essential for various electronic applications, including transistors, diodes, and integrated circuits.Electrical & Electronic EquipmentNot Available
CEDs000138Lubricants?Lubricants are synthetic or petroleum-derived substances used to reduce friction between surfaces in machinery and equipment, enhancing operational efficiency and longevity.Energy, oil & gasNot Available
CEDs000147Food packaging?Food packaging often utilizes synthetic chemicals, such as plastics and coatings, to enhance durability, moisture resistance, and shelf life.Food, food processing & cookwareNot Available
CEDs000174Lubricants?Lubricants are synthetic or petroleum-based substances used to reduce friction and wear between moving parts in machinery and equipment.Industrial manufacturing & chemical processingNot Available
CEDs000234Medical devices?Medical devices often incorporate synthetic chemicals in their manufacturing processes, which can contribute to contamination in healthcare settings.Healthcare, pharmaceuticals & veterinary productsNot Available
CEDs000451Carpets and Rugs?Carpets and rugs are commonly manufactured using synthetic fibers such as nylon, polyester, and polypropylene, which can be derived from petrochemical sources.Textiles, leather & furnishingsNot Available
CEDs000454Synthetic textiles?Synthetic textiles are materials derived from man-made fibers, such as polyester, nylon, and acrylic, which are produced through chemical processes involving petrochemicals.Textiles, leather & furnishingsNot Available
CEDs000490Personal care & cosmeticsNot Available
CEDs000492Cell phones?Cell phones contain a variety of synthetic chemicals and materials, including plastics, metals, and glass, which can contribute to environmental contamination.Electrical & Electronic EquipmentNot Available
CEDs000493Capacitors?Capacitors are electronic components that store and release electrical energy, often using dielectric materials that can include synthetic chemicals.Electrical & Electronic EquipmentNot Available
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Neuropeptide Y receptor type 4 structureClick to view 3D structureNeuropeptide Y receptor type 4P50391HumansPredicted (SEA)
Prediction Confidence Score
0.342
Applicability Domain
0.507
Statistical Significance
0.0122
Supporting Reference Compounds
23
E-value
94.8204
Click to view 3D structureSerine-threonine protein phosphatase 2A regulatory subunitQ8AWE3Gallus gallusPredicted (SEA)
Prediction Confidence Score
0.335
Applicability Domain
0.507
Statistical Significance
3.00e-05
Supporting Reference Compounds
12
E-value
0.233548
Click to view 3D structureSerine/threonine-protein phosphatase 2A catalytic subunit alpha isoformP67774Bos taurusPredicted (SEA)
Prediction Confidence Score
0.311
Applicability Domain
0.331
Statistical Significance
1.50e-04
Supporting Reference Compounds
2
E-value
1.16774
Tyrosine-protein phosphatase non-receptor type 1 structureClick to view 3D structureTyrosine-protein phosphatase non-receptor type 1P18031HumansPredicted (SEA)
Prediction Confidence Score
0.31
Applicability Domain
0.507
Statistical Significance
0.0078
Supporting Reference Compounds
197
E-value
61.1116
Protein phosphatase 1A structureClick to view 3D structureProtein phosphatase 1AP35813HumansPredicted (SEA)
Prediction Confidence Score
0.283
Applicability Domain
0.507
Statistical Significance
1.00e-05
Supporting Reference Compounds
2
E-value
0.0778492
C5a anaphylatoxin chemotactic receptor 1 structureClick to view 3D structureC5a anaphylatoxin chemotactic receptor 1P30993Mus musculusPredicted (SEA)
Prediction Confidence Score
0.264
Applicability Domain
0.264 Low confidence
Statistical Significance
0.0221
Supporting Reference Compounds
1
E-value
171.813
Tissue factor pathway inhibitor 2 structureClick to view 3D structureTissue factor pathway inhibitor 2P48307HumansPredicted (SEA)
Prediction Confidence Score
0.262
Applicability Domain
0.507
Statistical Significance
2.00e-05
Supporting Reference Compounds
7
E-value
0.155698
Serine/threonine-protein phosphatase 2A 56 kDa regulatory subunit alpha isoform structureClick to view 3D structureSerine/threonine-protein phosphatase 2A 56 kDa regulatory subunit alpha isoformQ15172HumansPredicted (SEA)
Prediction Confidence Score
0.26
Applicability Domain
0.507
Statistical Significance
1.00e-05
Supporting Reference Compounds
3
E-value
0.0778492
Mu-type opioid receptor structureClick to view 3D structureMu-type opioid receptorP35372HumansPredicted (SEA)
Prediction Confidence Score
0.26
Applicability Domain
0.266 Low confidence
Statistical Significance
0.1628
Supporting Reference Compounds
527
E-value
1267.62
Click to view 3D structureNeuropeptide FF receptor 2Q9Y5X5HumansPredicted (SEA)
Prediction Confidence Score
0.258
Applicability Domain
0.261 Low confidence
Statistical Significance
0.0318
Supporting Reference Compounds
25
E-value
247.638
Click to view 3D structureNeuropeptide FF receptor 1Q9GZQ6HumansPredicted (SEA)
Prediction Confidence Score
0.256
Applicability Domain
0.261 Low confidence
Statistical Significance
0.0313
Supporting Reference Compounds
21
E-value
243.435
Click to view 3D structurePhospholipid-transporting ATPase ABCA1P41233Mus musculusPredicted (SEA)
Prediction Confidence Score
0.256
Applicability Domain
0.256 Low confidence
Statistical Significance
0.0193
Supporting Reference Compounds
1
E-value
150.483
Plasma kallikrein structureClick to view 3D structurePlasma kallikreinP03952HumansPredicted (SEA)
Prediction Confidence Score
0.255
Applicability Domain
0.266 Low confidence
Statistical Significance
0.0668
Supporting Reference Compounds
158
E-value
520.188
Kappa-type opioid receptor structureClick to view 3D structureKappa-type opioid receptorP41145HumansPredicted (SEA)
Prediction Confidence Score
0.254
Applicability Domain
0.261 Low confidence
Statistical Significance
0.1945
Supporting Reference Compounds
532
E-value
1514.25
Delta-type opioid receptor structureClick to view 3D structureDelta-type opioid receptorP41143HumansPredicted (SEA)
Prediction Confidence Score
0.253
Applicability Domain
0.259 Low confidence
Statistical Significance
0.1471
Supporting Reference Compounds
427
E-value
1144.85
Click to view 3D structureNeuromedin-U receptor 2Q8BZ39Mus musculusPredicted (SEA)
Prediction Confidence Score
0.252
Applicability Domain
0.252 Low confidence
Statistical Significance
0.0253
Supporting Reference Compounds
1
E-value
196.959
Coagulation factor X structureClick to view 3D structureCoagulation factor XP00742HumansPredicted (SEA)
Prediction Confidence Score
0.25
Applicability Domain
0.27 Low confidence
Statistical Significance
0.1207
Supporting Reference Compounds
284
E-value
939.562
Inducible T-cell costimulator structureClick to view 3D structureInducible T-cell costimulatorQ9Y6W8HumansPredicted (SEA)
Prediction Confidence Score
0.25
Applicability Domain
0.25 Low confidence
Statistical Significance
0.0082
Supporting Reference Compounds
1
E-value
64.1478
Plasma kallikrein structureClick to view 3D structurePlasma kallikreinP26262Mus musculusPredicted (SEA)
Prediction Confidence Score
0.249
Applicability Domain
0.266 Low confidence
Statistical Significance
0.0092
Supporting Reference Compounds
7
E-value
71.8548
Plasminogen structureClick to view 3D structurePlasminogenP00747HumansPredicted (SEA)
Prediction Confidence Score
0.247
Applicability Domain
0.253 Low confidence
Statistical Significance
0.0975
Supporting Reference Compounds
195
E-value
759.419
Prothrombin structureClick to view 3D structureProthrombinP00734HumansPredicted (SEA)
Prediction Confidence Score
0.247
Applicability Domain
0.251 Low confidence
Statistical Significance
0.1526
Supporting Reference Compounds
331
E-value
1187.75
Thymic stromal lymphopoietin structureClick to view 3D structureThymic stromal lymphopoietinQ969D9HumansPredicted (SEA)
Prediction Confidence Score
0.246
Applicability Domain
0.246 Low confidence
Statistical Significance
0.009
Supporting Reference Compounds
1
E-value
70.3757
Click to view 3D structureMelanocyte-stimulating hormone receptorQ01727Mus musculusPredicted (SEA)
Prediction Confidence Score
0.244
Applicability Domain
0.254 Low confidence
Statistical Significance
0.0356
Supporting Reference Compounds
31
E-value
277.455
Click to view 3D structureMelanocortin receptor 4P56450Mus musculusPredicted (SEA)
Prediction Confidence Score
0.241
Applicability Domain
0.25 Low confidence
Statistical Significance
0.0385
Supporting Reference Compounds
34
E-value
299.408
Coagulation factor XI structureClick to view 3D structureCoagulation factor XIP03951HumansPredicted (SEA)
Prediction Confidence Score
0.241
Applicability Domain
0.258 Low confidence
Statistical Significance
0.0616
Supporting Reference Compounds
105
E-value
479.629
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available