<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-03-31 20:45:45 UTC</creation_date>
  <update_date>2026-05-20 19:27:31 UTC</update_date>
  <accession/>
  <common_name>Oligomycin A</common_name>
  <class>SmallMolecule</class>
  <description>Oligomycin A is a compound with the chemical formula C45H74O11. Oligomycin A belongs to the macrolides and analogues, a class of phenylpropanoids and polyketides within the organic compounds. With an average molecular weight of 791.08 g/mol, Oligomycin A is a heavy molecule. This substance is found in or released from two recorded sources: antibiotics within healthcare, pharmaceuticals &amp; veterinary products, and the preparation of wort within food, food processing &amp; cookware. Recorded exposure routes for the compound include oral and inhalation.</description>
  <categories/>
  <types/>
  <synonyms>
    <synonym>(1R,4E,5'S,6S,6'S,7R,8S,10R,11R,12S,14R,15S,16R,18E,20E,22R,25S,27R,28S,29R)-22-ethyl-7,11,14,15-tetrahydroxy-6'-[(2R)-2-hydroxypropyl]-5',6,8,10,12,14,16,28,29-nonamethyl-3',4',5',6'-tetrahydro-3H,9H,13H-spiro[2,26-dioxabicyclo[23.3.1]nonacosa-4,18,20-tr</synonym>
    <synonym>209-437-3</synonym>
    <synonym>NSC 303580 |</synonym>
    <synonym>Oligomycin A</synonym>
    <synonym>Oligomycin A fromStreptomyces diastatochromogenes</synonym>
    <synonym>Oligomycin A, Streptomyces diastatochromogenes.</synonym>
    <synonym>Oligomycin, Streptomyces diastatochromogenes</synonym>
    <synonym>Oligomycins</synonym>
    <synonym>RK3328000</synonym>
    <synonym>[579-13-5]</synonym>
  </synonyms>
  <chemical_formula>C45H74O11</chemical_formula>
  <average_molecular_weight>791.076</average_molecular_weight>
  <monisotopic_moleculate_weight>790.523113</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>579-13-5;1404-19-9;14104-19-9</cas_registry_number>
  <smiles>[H]C1(C)[C@@H]2CC[C@@]([H])(CC)C=CC=CC[C@@H](C)[C@H](O)[C@@](C)(O)C(=O)[C@@H](C)[C@H](O)[C@@H](C)C(=O)[C@@H](C)[C@H](O)[C@@H](C)C=CC(=O)O[C@H]1[C@H](C)[C@@]1(CC[C@H](C)[C@H](C[C@@H](C)O)O1)O2</smiles>
  <inchi>InChI=1S/C45H74O11/c1-12-34-17-15-13-14-16-27(4)42(51)44(11,53)43(52)32(9)40(50)31(8)39(49)30(7)38(48)26(3)18-21-37(47)54-41-29(6)35(20-19-34)55-45(33(41)10)23-22-25(2)36(56-45)24-28(5)46/h13-15,17-18,21,25-36,38,40-42,46,48,50-51,53H,12,16,19-20,22-24H2,1-11H3/b14-13+,17-15+,21-18+/t25-,26-,27+,28+,29+,30-,31-,32-,33-,34-,35-,36-,38+,40+,41+,42-,44+,45-/m1/s1</inchi>
  <inchikey>MNULEGDCPYONBU-WMBHJXFZSA-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>average_mass</kind>
      <value>791.076</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>790.523113</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>[H]C1(C)[C@@H]2CC[C@@]([H])(CC)C=CC=CC[C@@H](C)[C@H](O)[C@@](C)(O)C(=O)[C@@H](C)[C@H](O)[C@@H](C)C(=O)[C@@H](C)[C@H](O)[C@@H](C)C=CC(=O)O[C@H]1[C@H](C)[C@@]1(CC[C@H](C)[C@H](C[C@@H](C)O)O1)O2</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C45H74O11</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C45H74O11/c1-12-34-17-15-13-14-16-27(4)42(51)44(11,53)43(52)32(9)40(50)31(8)39(49)30(7)38(48)26(3)18-21-37(47)54-41-29(6)35(20-19-34)55-45(33(41)10)23-22-25(2)36(56-45)24-28(5)46/h13-15,17-18,21,25-36,38,40-42,46,48,50-51,53H,12,16,19-20,22-24H2,1-11H3/b14-13+,17-15+,21-18+/t25-,26-,27+,28+,29+,30-,31-,32-,33-,34-,35-,36-,38+,40+,41+,42-,44+,45-/m1/s1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>MNULEGDCPYONBU-WMBHJXFZSA-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:0x00007f726c35e748&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>5281899</pubchem_compound_id>
  <chembl_id/>
  <chemspider_id>10308285</chemspider_id>
  <kegg_id/>
  <uniprot_id/>
  <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>
