<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">97464</id>
  <title nil="true"/>
  <common-name>Benzofuran-3,6,7-triol triacetate</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>106649</pubchem-id>
  <chemical-formula>C14H12O7</chemical-formula>
  <weight>292.24</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">2026-04-05T05:18:06Z</created-at>
  <updated-at type="dateTime">2026-08-28T05:06:50Z</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>CC(=O)OC1=COC2=C1C=CC(OC(C)=O)=C2OC(C)=O</moldb-smiles>
  <moldb-formula>C14H12O7</moldb-formula>
  <moldb-inchi>InChI=1/C14H12O7/c1-7(15)19-11-5-4-10-12(20-8(2)16)6-18-13(10)14(11)21-9(3)17/h4-6H,1-3H3</moldb-inchi>
  <moldb-inchikey>YHHAGKFFIBSYDQ-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">292.243</moldb-average-mass>
  <moldb-mono-mass type="decimal">292.0583027</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.6</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>CHEM093357</chemdb-id>
  <dsstox-id>DTXSID10887162</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00059784</susdat-id>
  <iupac>(3,7-diacetyloxy-1-benzofuran-6-yl) acetate</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>Benzofurans</klass>
  <subklass nil="true"/>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0158690</sync-id>
  <structure-inchikey>YHHAGKFFIBSYDQ-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>200000000040040000000400000000000000000000000000000000000000400000000000080000000000000000000000000000000000000000000000000800000001000000020800000000100000000000000000000000000010000000000000000000000000000000000000000000000000000400010000040000000000000000000000000000000000000000000400000000000000100000000000000040000080000000000000010000008000000000000000000000020000000000000000000000000000000000000000044000200000100000000000000000000000040400000000400000000000020000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������(�������(�������(������@(������@h�������@(������@(������@(������@h�������@h�������@(�������(�������(�������`�������(������@(�������(�������(�������`�������(�����������(��� �� ��h���h���h���h��	h�	
h�
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��������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:37:35Z</structure-indexed-at>
</compound>
