<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-04-04 19:15:54 UTC</creation_date>
  <update_date>2026-04-04 19:15:54 UTC</update_date>
  <accession/>
  <common_name>Lup-20(29)-en-28-oic acid, 3-hydroxy-, (3ß)-</common_name>
  <class>SmallMolecule</class>
  <description>Lup-20(29)-en-28-oic acid, 3-hydroxy-, (3ß)- belongs to the triterpenoids, a subclass of prenol lipids within the organic compounds. This compound has the chemical formula C30H48O3. It has been recorded in three sources, including food, food processing and cookware specifically in the preparation of vinegar, as well as household cleaning and consumer products such as tobacco product cases, cigarettes, and cigars.

The compound is associated with several therapeutic effects across various malignancies. It has demonstrated therapeutic effects on cancer (PMC2877157), breast cancer (PMC10144513, PMC5617437), lung cancer (PMC10144513), colon cancer (PMC3128656), melanoma (PMC2877157, PMC5617437), and multiple myeloma (PMC2877157). Additionally, it is used as a treatment for pancreatic cancer (PMC3636171).</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C30H48O3</chemical_formula>
  <average_molecular_weight/>
  <monisotopic_moleculate_weight>456.3603454</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>472-15-1</cas_registry_number>
  <smiles/>
  <inchi>InChI=1/C30H48O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-24,31H,1,8-17H2,2-7H3,(H,32,33)</inchi>
  <inchikey>QGJZLNKBHJESQX-FZFNOLFKSA-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>
    <pathway>
      <name>Betulinic Acid Drug Metabolism Action Pathway</name>
      <smpdb_id>SMP0144865</smpdb_id>
      <kegg_map_id/>
    </pathway>
  </pathways>
  <state/>
  <appearance/>
  <experimental_properties/>
  <predicted_properties>
    <property>
      <kind>mono_mass</kind>
      <value>456.3603454</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C30H48O3</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1/C30H48O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-24,31H,1,8-17H2,2-7H3,(H,32,33)</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>QGJZLNKBHJESQX-FZFNOLFKSA-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:0x00007f72273751e0&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>64971</pubchem_compound_id>
  <chembl_id/>
  <chemspider_id/>
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  <biocyc_id/>
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  <wikipidia/>
  <general_references/>
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</compound>
