<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">88413</id>
  <title nil="true"/>
  <common-name>10,11-Dihydro-5-[3-(methylamino)propyl]-5H-dibenzo[a,d]cyclohepten-5-ol</common-name>
  <description>10,11-Dihydro-5-[3-(methylamino)propyl]-5H-dibenzo[a,d]cyclohepten-5-ol belongs to the dibenzocycloheptenes, a class of benzenoids within the organic compounds. This compound has the chemical formula C19H23NO and an average molecular weight of 281.40 g/mol.</description>
  <cas>2939-66-4</cas>
  <pubchem-id>76249</pubchem-id>
  <chemical-formula>C19H23NO</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">2026-04-04T22:51:47Z</created-at>
  <updated-at type="dateTime">2026-04-04T22:51:47Z</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>CNCCCC1(O)C2=CC=CC=C2CCC2=CC=CC=C12</moldb-smiles>
  <moldb-formula>C19H23NO</moldb-formula>
  <moldb-inchi>InChI=1/C19H23NO/c1-20-14-6-13-19(21)17-9-4-2-7-15(17)11-12-16-8-3-5-10-18(16)19/h2-5,7-10,20-21H,6,11-14H2,1H3</moldb-inchi>
  <moldb-inchikey>VGYXEZXCFKVWAP-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">281.399</moldb-average-mass>
  <moldb-mono-mass type="decimal">281.1779644</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>CHEM084306</chemdb-id>
  <dsstox-id>DTXSID20951924</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00049144</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>Benzenoids</superklass>
  <klass>Dibenzocycloheptenes</klass>
  <subklass nil="true"/>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0115382</sync-id>
  <structure-inchikey>VGYXEZXCFKVWAP-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>8000000000000020000000000000000000000000000000000000000000000000000008000000000000000000000000000020000000000000000000000000000000000000000000000010000000000000000000000000000000100100000000000080000000080000000200000000000000000000000000000000480000008000000000000000a0000000000100000000080000000000000000000000000000000000080000000000020000000800000000000000000000000000000000000000000000000000400000000008000000220a00000000000000000000000001000040000000010000000000000000080010000000000000</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�	
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  <structure-indexed-at type="dateTime">2026-09-19T04:32:04Z</structure-indexed-at>
</compound>
