<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">346367</id>
  <title nil="true"/>
  <common-name>7-methoxy-2,2-dimethyl-3-phenyl-4-(4-prop-2-enoxyphenyl)chromene</common-name>
  <description>7-methoxy-2,2-dimethyl-3-phenyl-4-(4-prop-2-enoxyphenyl)chromene is a compound with the formula C27H26O3. It has an average molecular weight of 398.50 g/mol.</description>
  <cas>123886-63-5</cas>
  <pubchem-id>3079008</pubchem-id>
  <chemical-formula>C27H26O3</chemical-formula>
  <weight>398.5</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">2026-08-31T09:47:15Z</created-at>
  <updated-at type="dateTime">2026-08-31T09:47:15Z</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(=C(C2=C(O1)C=C(C=C2)OC)C3=CC=C(C=C3)OCC=C)C4=CC=CC=C4)C</moldb-smiles>
  <moldb-formula>C27H26O3</moldb-formula>
  <moldb-inchi>InChI=1S/C27H26O3/c1-5-17-29-21-13-11-19(12-14-21)25-23-16-15-22(28-4)18-24(23)30-27(2,3)26(25)20-9-7-6-8-10-20/h5-16,18H,1,17H2,2-4H3</moldb-inchi>
  <moldb-inchikey>DMQBARJBKYJCSC-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">398.1881947</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>5.8</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>CHEM342260</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-methoxy-2,2-dimethyl-3-phenyl-4-(4-prop-2-enoxyphenyl)chromene</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>Isoflavonoids</klass>
  <subklass>O-methylated isoflavonoids</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0296720</sync-id>
  <structure-inchikey>DMQBARJBKYJCSC-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>200000080000200000000000000000000000000000000000000000000000000000028000000a000000004000000000000004000000020000000400000000000000000000000000000000004800000800300000200008000000000040000000000000040000000100000800000001008000000000000000020000000000048000000800000000000000000800000000100000000000000000020200000000000000000000200080000000000000000080000000000100000000090000000000000200000000000040000000000000000000000000200010000000000000000000000000040000009400000000000100008000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAeAAAAIQAAAIABBgBgAAAAAQMGACAAAAAE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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:45:07Z</structure-indexed-at>
</compound>
