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<compound>
  <id type="integer">364003</id>
  <title nil="true"/>
  <common-name>(1r,2r,6s,7s,8s,10r)-4,9,11-trioxatetracyclo[5.3.1.02,6.08,10]undecane-3,5-dione</common-name>
  <description>(1r,2r,6s,7s,8s,10r)-4,9,11-trioxatetracyclo[5.3.1.02,6.08,10]undecane-3,5-dione is a chemical compound with the formula C8H6O5. It has an average molecular weight of 182.13 g/mol.</description>
  <cas>82660-86-4</cas>
  <pubchem-id>134062</pubchem-id>
  <chemical-formula>C8H6O5</chemical-formula>
  <weight>182.13</weight>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility nil="true"/>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2026-09-01T13:44:36Z</created-at>
  <updated-at type="dateTime">2026-09-01T13:44:36Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>C12C(C3C4C(C1O3)O4)C(=O)OC2=O</moldb-smiles>
  <moldb-formula>C8H6O5</moldb-formula>
  <moldb-inchi>InChI=1S/C8H6O5/c9-7-1-2(8(10)13-7)4-6-5(12-6)3(1)11-4/h1-6H/t1-,2+,3-,4+,5-,6+</moldb-inchi>
  <moldb-inchikey>DEEDDGAXEIHTMA-JMVOWJSSSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">182.0215233</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-1.1</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM359896</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>(1r,2r,6s,7s,8s,10r)-4,9,11-trioxatetracyclo[5.3.1.02,6.08,10]undecane-3,5-dione</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Organoheterocyclic compounds</superklass>
  <klass>Furofurans</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0314024</sync-id>
  <structure-inchikey>DEEDDGAXEIHTMA-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000000000000000020000000080000000000080000000000000000000000000000000000000000000000000000000000000020800000000000000000000000000000000000000000000000000000000000000000000004000000000040000000100000000000000000000000000000000000000000000000000000000800000000000000000000000000000000080000080000000000004000000000000000000000000000000000000000010000000000000000000000000000000000000000000000200000000000000000000000000040000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>50160220050a8e4088584a44010831000100140211052000103562408200000c4423081012a400000148410800c00040052000a4419c321100a6447040a0411085110c0c1210142000901060006227004840058151411a3256042d72502659804c6800171048220060228601c4340000200680128015e4041108287082510102404600094cd8a60008040389882c4208390c8a524440140200240c0030c0808410c110220102500206022948816d211002c00001a941084058a0421008c00312880100a40490809301810003151102800405600002045020850022560a000140111028100000c02000000401d112a0040c1002309042800f0008150050000842</structure-pattern-fingerprint>
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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T06:00:27Z</structure-indexed-at>
</compound>
