[D‐Asp3,(E)-Dhb7]MC‐HtyY (CED0043858)

Record Information
Version1.0
Creation Date2026-04-06 08:36:35 UTC
Update Date2026-05-21 08:47:34 UTC
Accession NumberCHEM120624
Identification
Common Name[D‐Asp3,(E)-Dhb7]MC‐HtyY
ClassSmall Molecule
Description
[D‐Asp3,(E)-Dhb7]MC‐HtyY belongs to the hybrid peptides, a subclass of peptidomimetics within the organic compounds. This organic acid and derivative possesses the chemical formula C55H69N7O14. The compound has been identified in or released from 13 recorded sources across several diverse sectors. Within electrical and electronic equipment, it is found in cell phones, capacitors, wires and cables, batteries, and printed circuit boards, among one other source. It is present in the textiles, leather and furnishings sector, specifically in synthetic textiles as well as carpets and rugs. In the food, food processing and cookware sector, it is associated with food packaging. Furthermore, it is found in medical devices within the healthcare, pharmaceuticals and veterinary products sector. The compound is also utilized as lubricants in both the energy, oil and gas sector and the industrial manufacturing and chemical processing sector, in addition to one more sector. Recorded routes of exposure for this compound include inhalation, oral ingestion, and touch.
Contaminant Type
  • PFAS
Chemical Structure
SynonymsNot Available
Chemical FormulaC55H69N7O14
Average Molecular MassNot Available
Monoisotopic Mass1051.490 g/mol
CAS Registry NumberNot Available
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C55H69N7O14/c1-7-40-51(69)56-34(5)50(68)60-42(24-18-35-14-19-38(63)20-15-35)52(70)62-45(55(74)75)30-48(66)58-44(28-37-16-21-39(64)22-17-37)53(71)59-41(33(4)49(67)61-43(54(72)73)25-26-47(65)57-40)23-13-31(2)27-32(3)46(76-6)29-36-11-9-8-10-12-36/h7-17,19-23,27,32-34,41-46,63-64H,18,24-26,28-30H2,1-6H3,(H,56,69)(H,57,65)(H,58,66)(H,59,71)(H,60,68)(H,61,67)(H,62,70)(H,72,73)(H,74,75)/b23-13+,31-27+,40-7+/t32-,33-,34+,41-,42-,43+,44-,45+,46-/m0/s1
InChI KeyWIUASVUEJTVYML-YBHJWNOCSA-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 ValuesNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
7PesticidesAgriculture & land managementNot Available
120Wires and cablesElectrical & Electronic EquipmentNot Available
121Printed circuit boardsElectrical & Electronic EquipmentNot Available
125BatteriesElectrical & Electronic EquipmentNot Available
130SemiconductorsElectrical & Electronic EquipmentNot Available
138LubricantsEnergy, oil & gasNot Available
147Food packagingFood, food processing & cookwareNot Available
174LubricantsIndustrial manufacturing & chemical processingNot Available
234Medical devicesHealthcare, pharmaceuticals & veterinary productsNot Available
451Carpets and RugsTextiles, leather & furnishingsNot Available
454Synthetic textilesTextiles, leather & furnishingsNot Available
490Personal care & cosmeticsNot Available
492Cell phonesElectrical & Electronic EquipmentNot Available
493CapacitorsElectrical & 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 structureSerine/threonine-protein phosphatase 2A catalytic subunit alpha isoformP67774Bos taurusPredicted (SEA)0.233548
Click to view 3D structureSerine-threonine protein phosphatase 2A regulatory subunitQ8AWE3Gallus gallusPredicted (SEA)0.389246
Click to view 3D structureMu-type opioid receptorP33535Rattus norvegicusPredicted (SEA)876.894
Delta-type opioid receptor structureClick to view 3D structureDelta-type opioid receptorP41143HumansPredicted (SEA)1875.15
Click to view 3D structureDelta-type opioid receptorP32300Mus musculusPredicted (SEA)620.692
Mu-type opioid receptor structureClick to view 3D structureMu-type opioid receptorP35372HumansPredicted (SEA)2455.13
Click to view 3D structureMu-opioid receptorQ8CGM4Cavia porcellusPredicted (SEA)272.005
Click to view 3D structureDelta-type opioid receptorP33533Rattus norvegicusPredicted (SEA)846.221
Neuropeptide Y receptor type 4 structureClick to view 3D structureNeuropeptide Y receptor type 4P50391HumansPredicted (SEA)251.219
Tyrosine-protein phosphatase non-receptor type 1 structureClick to view 3D structureTyrosine-protein phosphatase non-receptor type 1P18031HumansPredicted (SEA)884.056
Click to view 3D structureMu-type opioid receptorP97266Cavia porcellusPredicted (SEA)868.719
Click to view 3D structureKappa-type opioid receptorP41144Cavia porcellusPredicted (SEA)1257.97
Kappa-type opioid receptor structureClick to view 3D structureKappa-type opioid receptorP41145HumansPredicted (SEA)3754.67
Click to view 3D structureMu-type opioid receptorP42866Mus musculusPredicted (SEA)713.955
Click to view 3D structureUncharacterized proteinF1N083Bos taurusPredicted (SEA)321.128
Click to view 3D structureKappa-type opioid receptorP34975Rattus norvegicusPredicted (SEA)722.83
Click to view 3D structureSubstance-P receptorP14600Rattus norvegicusPredicted (SEA)590.72
Cathepsin B structureClick to view 3D structureCathepsin BP07858HumansPredicted (SEA)2431.0
Click to view 3D structureSigma non-opioid intracellular receptor 1Q60492Cavia porcellusPredicted (SEA)3011.36
Glutamate receptor ionotropic, NMDA 2B structureClick to view 3D structureGlutamate receptor ionotropic, NMDA 2BQ13224HumansPredicted (SEA)1439.51
Click to view 3D structureSigma intracellular receptor 2Q5U3Y7Rattus norvegicusPredicted (SEA)2104.26
Proenkephalin-B structureClick to view 3D structureProenkephalin-BP01213HumansPredicted (SEA)390.647
Breast cancer type 1 susceptibility protein structureClick to view 3D structureBreast cancer type 1 susceptibility proteinP38398HumansPredicted (SEA)376.167
Prothrombin structureClick to view 3D structureProthrombinP00734HumansPredicted (SEA)4163.3
Procathepsin L structureClick to view 3D structureProcathepsin LP07711HumansPredicted (SEA)2893.81
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available