<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">310572</id>
  <title nil="true"/>
  <common-name>7,12-dihydrobenzo[a]anthracene-7,12-diol</common-name>
  <description>7,12-dihydrobenzo[a]anthracene-7,12-diol is a chemical compound with the formula C18H14O2. It has an average molecular weight of 262.30 g/mol.</description>
  <cas>4615-78-5</cas>
  <pubchem-id>107309</pubchem-id>
  <chemical-formula>C18H14O2</chemical-formula>
  <weight>262.3</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">2026-08-29T05:58:52Z</created-at>
  <updated-at type="dateTime">2026-08-29T05:58:52Z</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>C1=CC=C2C(=C1)C=CC3=C2C(C4=CC=CC=C4C3O)O</moldb-smiles>
  <moldb-formula>C18H14O2</moldb-formula>
  <moldb-inchi>InChI=1S/C18H14O2/c19-17-13-7-3-4-8-14(13)18(20)16-12-6-2-1-5-11(12)9-10-15(16)17/h1-10,17-20H</moldb-inchi>
  <moldb-inchikey>AYYXQZYAKKRSHB-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">262.0993797</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.9</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>CHEM306465</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>7,12-dihydrobenzo[a]anthracene-7,12-diol</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>Benzenoids</superklass>
  <klass>Phenanthrenes and derivatives</klass>
  <subklass>Phenanthrols</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0261546</sync-id>
  <structure-inchikey>AYYXQZYAKKRSHB-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>8000000000000000000000000000000000000100000000000000000000000000000000000000000100000000000000000000000000000020000000000000000000000000000000000000000000000000000000000000000000000000000010000000000000000000000000000000000000000000000000000101001000000000001800080000000000000000000000100000000000000400000000000000000000040040000080000000000000000000000000000200000000000000000040000000000100000108000000000000008000000000200000000000000000000000001000040000000000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€��@h�������@h�������@h�������@(������@(������@h�������@h�������@h�������@(������@(�������`������@(������@h�������@h�������@h�������@h�������@(�������`�������`�������`��������h���h���h���h���h���h���h���h��	h�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:17:58Z</structure-indexed-at>
</compound>
