<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-04-06 04:11:43 UTC</creation_date>
  <update_date>2026-05-14 19:08:40 UTC</update_date>
  <accession/>
  <common_name>Methscopolamine</common_name>
  <class>SmallMolecule</class>
  <description>Methscopolamine is an organic compound with the formula C18H24NO4 and an average molecular weight of 318.39 g/mol. Methscopolamine belongs to the beta hydroxy acids and derivatives, a subclass of hydroxy acids and derivatives within the organic compounds.

This compound is found in or released from three recorded sources, including pharmaceuticals &amp; veterinary products such as mydriatics and cycloplegics, antispasmodics in combination with psycholeptics, and belladonna and derivatives. The recorded route of exposure is oral. In terms of its biological activity, methscopolamine acts as an antagonist for two recorded protein targets: the muscarinic acetylcholine receptor M2 (CHRM2) and the muscarinic acetylcholine receptor M3 (CHRM3).</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C18H24NO4</chemical_formula>
  <average_molecular_weight>318.392</average_molecular_weight>
  <monisotopic_moleculate_weight>318.1705332</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>13265-10-6</cas_registry_number>
  <smiles>C[N+]1(C)[C@H]2C[C@@H](C[C@@H]1[C@H]1O[C@@H]21)OC(=O)[C@H](CO)C1=CC=CC=C1</smiles>
  <inchi>InChI=1S/C18H24NO4/c1-19(2)14-8-12(9-15(19)17-16(14)23-17)22-18(21)13(10-20)11-6-4-3-5-7-11/h3-7,12-17,20H,8-10H2,1-2H3/q+1/t12-,13-,14-,15+,16-,17+/m1/s1</inchi>
  <inchikey>LZCOQTDXKCNBEE-IKIFYQGPSA-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>
    <property>
      <kind>logp</kind>
      <value>-3.3</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>318.392</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>318.1705332</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>C[N+]1(C)[C@H]2C[C@@H](C[C@@H]1[C@H]1O[C@@H]21)OC(=O)[C@H](CO)C1=CC=CC=C1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C18H24NO4</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C18H24NO4/c1-19(2)14-8-12(9-15(19)17-16(14)23-17)22-18(21)13(10-20)11-6-4-3-5-7-11/h3-7,12-17,20H,8-10H2,1-2H3/q+1/t12-,13-,14-,15+,16-,17+/m1/s1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>LZCOQTDXKCNBEE-IKIFYQGPSA-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:0x00007f7245308ae0&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id>DB11315</drugbank_id>
  <hmdb_id/>
  <pubchem_compound_id/>
  <chembl_id/>
  <chemspider_id>21106347</chemspider_id>
  <kegg_id/>
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  <omim_id/>
  <chebi_id/>
  <biocyc_id/>
  <ctd_id/>
  <stitch_id/>
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  <pdb_id/>
  <wikipidia/>
  <general_references/>
  <targets>
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</compound>
