<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">321276</id>
  <title nil="true"/>
  <common-name>(2s)-5-hydroxy-8,8-dimethyl-2-phenyl-2,3-dihydropyrano[2,3-h]chromen-4-one</common-name>
  <description>(2s)-5-hydroxy-8,8-dimethyl-2-phenyl-2,3-dihydropyrano[2,3-h]chromen-4-one is a chemical compound with the formula C20H18O4. It has an average molecular weight of 322.40 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>13940733</pubchem-id>
  <chemical-formula>C20H18O4</chemical-formula>
  <weight>322.4</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">2026-08-29T20:39:30Z</created-at>
  <updated-at type="dateTime">2026-08-29T20:39:30Z</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>CC1(C=CC2=C(O1)C=C(C3=C2OC(CC3=O)C4=CC=CC=C4)O)C</moldb-smiles>
  <moldb-formula>C20H18O4</moldb-formula>
  <moldb-inchi>InChI=1S/C20H18O4/c1-20(2)9-8-13-17(24-20)11-15(22)18-14(21)10-16(23-19(13)18)12-6-4-3-5-7-12/h3-9,11,16,22H,10H2,1-2H3/t16-/m0/s1</moldb-inchi>
  <moldb-inchikey>VYVZELWVPQMZDE-INIZCTEOSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">322.1205091</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4</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>CHEM317169</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>(2s)-5-hydroxy-8,8-dimethyl-2-phenyl-2,3-dihydropyrano[2,3-h]chromen-4-one</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>Phenylpropanoids and polyketides</superklass>
  <klass>Flavonoids</klass>
  <subklass>Pyranoflavonoids</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0271998</sync-id>
  <structure-inchikey>VYVZELWVPQMZDE-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>42000000000004000000000000000000000000000000000000000800010000000000000000000020000000000000000004020000000000000040000000000000000000001000000000000000000000000020800000000000000000000003000000001000010000000000800000100000000000020000000004000000000000104000000048000000800000000000002000002000000108000000000000000021200200000000000000000000080004000000000000000000000000000000000000000000000000002100000000000001000000000000000000001600010000000000000000000000000040040000400000000000000000000000000000001000</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�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:26:10Z</structure-indexed-at>
</compound>
