Record Information
Version1.0
Creation Date2026-04-06 08:39:52 UTC
Update Date2026-05-21 08:53:21 UTC
Accession NumberCHEM120674
Identification
Common Name[D-Asp³]MC‐Htyr(OMe)R
ClassSmall Molecule
Description[D-Asp³]MC‐Htyr(OMe)R belongs to the hybrid peptides, a subclass of peptidomimetics within the organic compounds. This organic acid and derivative has the chemical formula C53H74N10O14. The compound has been identified in or released from 13 recorded sources across several sectors. Within Electrical & Electronic Equipment, it is found in batteries, capacitors, printed circuit boards, wires and cables, cell phones, and one additional source. In the Textiles, leather & furnishings sector, it is associated with synthetic textiles as well as carpets and rugs. It is also found in food packaging within the Food, food processing & cookware sector, and in medical devices within the Healthcare, pharmaceuticals & veterinary products sector. Additionally, the compound is present in lubricants used in both Energy, oil & gas and Industrial manufacturing & chemical processing, along with one other sector. Recorded routes of exposure for [D-Asp³]MC‐Htyr(OMe)R include inhalation, oral, and touch.
Contaminant SourcesNot Available
Contaminant Type
  • PFAS
Chemical Structure
Thumb
SynonymsNot Available
Chemical FormulaC53H74N10O14
Average Molecular MassNot Available
Monoisotopic Mass1074.539 g/mol
CAS Registry NumberNot Available
IUPAC Name15-(3-((diaminomethylene)amino)propyl)-18-((1E,3E)-6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dien-1-yl)-8-(4-methoxyphenethyl)-1,5,19-trimethyl-2-methylene-3,6,9,13,16,20,25-heptaoxo-1,4,7,10,14,17,21-heptaazacyclopentacosane-11,22-dicarboxylic acid
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C53H74N10O14/c1-29(25-30(2)42(76-7)26-34-13-10-9-11-14-34)16-19-36-31(3)46(67)61-39(51(72)73)21-23-45(66)63(6)33(5)48(69)57-32(4)47(68)60-38(20-17-35-18-22-41(64)43(27-35)77-8)50(71)62-40(52(74)75)28-44(65)58-37(49(70)59-36)15-12-24-56-53(54)55/h9-11,13-14,16,18-19,22,25,27,30-32,36-40,42,64H,5,12,15,17,20-21,23-24,26,28H2,1-4,6-8H3,(H,57,69)(H,58,65)(H,59,70)(H,60,68)(H,61,67)(H,62,71)(H,72,73)(H,74,75)(H4,54,55,56)/b19-16+,29-25+/t30-,31-,32+,36-,37-,38-,39+,40+,42-/m0/s1
InChI KeyZPYMAPRFVXDPFZ-DNLKICPHSA-N
Chemical Taxonomy
ClassificationNot classified
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
PathwaysNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyView
Toxicity Profile
Route of ExposureNot Available
Mechanism of ToxicityNot Available
MetabolismNot Available
Toxicity ValuesNot Available
Lethal DoseNot Available
Carcinogenicity (IARC Classification)Not Available
Uses/SourcesNot Available
Minimum Risk LevelNot Available
Health EffectsNot Available
SymptomsNot Available
TreatmentNot Available
Concentrations
Not Available
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available