<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-04-06 08:24:27 UTC</creation_date>
  <update_date>2026-05-21 08:21:55 UTC</update_date>
  <accession/>
  <common_name>[D‐Asp³,DMAdda5]MCLA</common_name>
  <class>SmallMolecule</class>
  <description>[D‐Asp³,DMAdda5]MCLA belongs to the hybrid peptides, a subclass of peptidomimetics within the organic compounds. This compound has the chemical formula C44H63N7O12.

The substance 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 present in food packaging within the food, food processing and cookware sector, and in medical devices within the healthcare, pharmaceuticals and veterinary products sector. Additionally, it is found in lubricants used in both the energy, oil and gas sector and the industrial manufacturing and chemical processing sector, along with one more sector. Recorded routes of exposure for this compound include inhalation, oral ingestion, and touch.</description>
  <categories/>
  <types>
    <type>PFAS</type>
  </types>
  <synonyms/>
  <chemical_formula>C44H63N7O12</chemical_formula>
  <average_molecular_weight/>
  <monisotopic_moleculate_weight>881.4534708</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number/>
  <smiles/>
  <inchi>InChI=1S/C44H63N7O12/c123(2)193342(59)5034(44(62)63)2236(53)4527(6)39(56)4731(161524(3)2025(4)35(52)2130131110121430)26(5)38(55)4832(43(60)61)171837(54)51(9)29(8)41(58)4628(7)40(57)4933/h1016,20,23,2528,3135,52H,8,1719,2122H2,17,9H3,(H,45,53)(H,46,58)(H,47,56)(H,48,55)(H,49,57)(H,50,59)(H,60,61)(H,62,63)/b1615+,2420+/t25,26,27,28+,31,32+,33,34+,35/m0/s1</inchi>
  <inchikey>YEECPBMSOJOCFK-BSBXEUFZSA-N</inchikey>
  <taxonomy>
    <kingdom/>
    <super_class/>
    <class/>
    <sub_class/>
    <direct_parent/>
    <alternate_parents/>
    <substituents/>
    <molecular_framework/>
    <descriptors/>
  </taxonomy>
  <status>Detected and Not Quantified</status>
  <origin/>
  <cellular_locations/>
  <biofluid_locations/>
  <tissue_locations/>
  <pathways/>
  <state/>
  <appearance/>
  <experimental_properties/>
  <predicted_properties>
    <property>
      <kind>mono_mass</kind>
      <value>881.4534708</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C44H63N7O12</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C44H63N7O12/c123(2)193342(59)5034(44(62)63)2236(53)4527(6)39(56)4731(161524(3)2025(4)35(52)2130131110121430)26(5)38(55)4832(43(60)61)171837(54)51(9)29(8)41(58)4628(7)40(57)4933/h1016,20,23,2528,3135,52H,8,1719,2122H2,17,9H3,(H,45,53)(H,46,58)(H,47,56)(H,48,55)(H,49,57)(H,50,59)(H,60,61)(H,62,63)/b1615+,2420+/t25,26,27,28+,31,32+,33,34+,35/m0/s1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>YEECPBMSOJOCFK-BSBXEUFZSA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
  <route_of_exposure/>
  <mechanism_of_toxicity/>
  <metabolism/>
  <toxicity/>
  <lethaldose/>
  <carcinogenicity/>
  <use_source/>
  <min_risk_level/>
  <health_effects>#&lt;HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f38221e7308&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>146684713</pubchem_compound_id>
  <chembl_id/>
  <chemspider_id/>
  <kegg_id/>
  <uniprot_id/>
  <omim_id/>
  <chebi_id/>
  <biocyc_id/>
  <ctd_id/>
  <stitch_id/>
  <actor_id/>
  <pdb_id/>
  <wikipidia/>
  <general_references/>
  <targets/>
</compound>
