<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">100700</id>
  <title nil="true"/>
  <common-name>3-Methoxy-17-methylmorphinan-4,6-diol</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>57354534</pubchem-id>
  <chemical-formula>C18H25NO3</chemical-formula>
  <weight nil="true"/>
  <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">2026-04-05T08:01:06Z</created-at>
  <updated-at type="dateTime">2026-04-05T08:01:06Z</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>[H]C1(O)CC[C@@]2([H])[C@@]3([H])CC4=C(C(O)=C(OC)C=C4)[C@@]2(CCN3C)C1</moldb-smiles>
  <moldb-formula>C18H25NO3</moldb-formula>
  <moldb-inchi>InChI=1/C18H25NO3/c1-19-8-7-18-10-12(20)4-5-13(18)14(19)9-11-3-6-15(22-2)17(21)16(11)18/h3,6,12-14,20-21H,4-5,7-10H2,1-2H3</moldb-inchi>
  <moldb-inchikey>SADZCZSUWMSOCW-HWSKEQOTSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">303.402</moldb-average-mass>
  <moldb-mono-mass type="decimal">303.1834437</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <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>CHEM096593</chemdb-id>
  <dsstox-id>DTXSID701005672</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00063810</susdat-id>
  <iupac nil="true"/>
  <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>Alkaloids and derivatives</superklass>
  <klass>Morphinans</klass>
  <subklass nil="true"/>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0115030</sync-id>
  <structure-inchikey>SADZCZSUWMSOCW-HWSKEQOTSA-N</structure-inchikey>
  <structure-fingerprint>200000000000000000000000000210000010000400000000000000100000000000000000000000004000000000000000002000000010000000000200008020000000000000000000001000100200000000000000000000000210000004040000000000000000000020108000001000000080000100001000068000000000000080000004000200000000000000000080000400000000000000004010000000000080000000000000000000000008000000000000080000000000000002000000000000000000000400000000010000200000000000000000000000000000040000000000000000000000020080000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���0�������`�������`�������`������ 4������� 4��������`������@(������@(������@(�������h�������@(�������(�������`������@h�������@h������� $�������`�������`������� ������`�������`�����������������������������h��	h�	
 	�h��� ����h���h������������������������������h�B�������������������	����������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T02:59:01Z</structure-indexed-at>
</compound>
