<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-04-04 08:42:15 UTC</creation_date>
  <update_date>2026-05-20 22:36:32 UTC</update_date>
  <accession/>
  <common_name>(3ÃŸ,4A,16a)-3,16-dihydroxy-23-oxoolean-12-en-28-oic acid</common_name>
  <class>SmallMolecule</class>
  <description>(3ÃŸ,4A,16a)-3,16-dihydroxy-23-oxoolean-12-en-28-oic acid belongs to the triterpenoids, a subclass of prenol lipids within the organic compounds. This compound has the chemical formula C30H46O5 and is classified within the superclass of lipids and lipid-like molecules.

The substance is found in or released from 13 recorded sources across several diverse sectors. Within the healthcare, pharmaceuticals &amp; veterinary products sector, it is associated with medical devices. In the food, food processing &amp; cookware sector, it is found in food packaging. It is present in lubricants used in both the energy, oil &amp; gas sector and the industrial manufacturing &amp; chemical processing sector. Additionally, it is found in textiles, leather &amp; furnishings, specifically in carpets, rugs, and synthetic textiles. The compound is also linked to electrical &amp; electronic equipment, including batteries, capacitors, cell phones, printed circuit boards, wires, cables, and one other source. One additional sector is also recorded as a source. Recorded exposure routes for this compound include touch, oral, and inhalation.</description>
  <categories/>
  <types>
    <type>PFAS</type>
    <type>Phytotoxin</type>
  </types>
  <synonyms>
    <synonym>(3?,4?,16?)-3,16-dihydroxy-23-oxoolean-12-en-28-oic acid</synonym>
    <synonym>(3beta,16alpha)-3,16-Dihydroxy-23-oxoolean-12-en-28-oic acid</synonym>
    <synonym>(3BETA,4A,16A)-3,16-DIHYDROXY-23-OXOOLEAN-12-EN-28-OIC ACID</synonym>
    <synonym>(3beta,4alpha,16alpha)-3,16-dihydroxy-23-oxoolean-12-en-28-oic acid</synonym>
    <synonym>(4aR,5R,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-5,10-dihydroxy-9-methanoyl-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid</synonym>
    <synonym>(4aR,5R,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-9-formyl-5,10-dihydroxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid</synonym>
    <synonym>(4AR,5R,6AS,6BR,8AR,9S,10S,12AR,12BR,14BS)-9-FORMYL-5,10-DIHYDROXY-2,2,6A,6B,9,12A-HEXAMETHYL-1,2,3,4,4A,5,6,6A,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-ICOSAHYDROPICENE-4A-CARBOXYLIC ACID</synonym>
    <synonym>(4aR,5R,6aS,6bR,8aR,9S,10S,12aR,12bR,14bS)-9-formyl-5,10-dihydroxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid</synonym>
    <synonym>211-149-8</synonym>
    <synonym>3b,16a-Dihydroxy-23-oxoolean-12-en-28-oic Acid</synonym>
    <synonym>EINECS 211-149-8</synonym>
    <synonym>MFCD22479218</synonym>
    <synonym>Olean-12-en-28-oic acid, 3,16-dihydroxy-23-oxo-, (3beta,16alpha)-</synonym>
    <synonym>Quillaic Acid</synonym>
    <synonym>Quillaja Sapogenin</synonym>
    <synonym>UNII-69O8E4G02B</synonym>
    <synonym>UNII:69O8E4G02B</synonym>
  </synonyms>
  <chemical_formula>C30H46O5</chemical_formula>
  <average_molecular_weight/>
  <monisotopic_moleculate_weight>486.334525</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>631-01-6</cas_registry_number>
  <smiles/>
  <inchi>InChI=1S/C30H46O5/c1-25(2)13-14-30(24(34)35)19(15-25)18-7-8-21-26(3)11-10-22(32)27(4,17-31)20(26)9-12-28(21,5)29(18,6)16-23(30)33/h7,17,19-23,32-33H,8-16H2,1-6H3,(H,34,35)/t19-,20+,21+,22-,23+,26-,27-,28+,29+,30+/m0/s1</inchi>
  <inchikey>MQUFAARYGOUYEV-UAWZMHPWSA-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>486.334525</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C30H46O5</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C30H46O5/c1-25(2)13-14-30(24(34)35)19(15-25)18-7-8-21-26(3)11-10-22(32)27(4,17-31)20(26)9-12-28(21,5)29(18,6)16-23(30)33/h7,17,19-23,32-33H,8-16H2,1-6H3,(H,34,35)/t19-,20+,21+,22-,23+,26-,27-,28+,29+,30+/m0/s1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>MQUFAARYGOUYEV-UAWZMHPWSA-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:0x00007f7222ef7310&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>101810</pubchem_compound_id>
  <chembl_id/>
  <chemspider_id>91986</chemspider_id>
  <kegg_id/>
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  <chebi_id/>
  <biocyc_id/>
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  <general_references/>
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</compound>
