<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">352284</id>
  <title nil="true"/>
  <common-name>6,7-dimethyl-3-[[methyl-[2-[methyl-[[1-[3-(trifluoromethyl)phenyl]indol-3-yl]methyl]amino]ethyl]amino]methyl]-4a,5,6,7,8,8a-hexahydrochromen-4-one</common-name>
  <description>6,7-dimethyl-3-[[methyl-[2-[methyl-[[1-[3-(trifluoromethyl)phenyl]indol-3-yl]methyl]amino]ethyl]amino]methyl]-4a,5,6,7,8,8a-hexahydrochromen-4-one is a chemical compound with the formula C32H38F3N3O2. With an average molecular weight of 553.70 g/mol, 6,7-dimethyl-3-[[methyl-[2-[methyl-[[1-[3-(trifluoromethyl)phenyl]indol-3-yl]methyl]amino]ethyl]amino]methyl]-4a,5,6,7,8,8a-hexahydrochromen-4-one is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>73234872</pubchem-id>
  <chemical-formula>C32H38F3N3O2</chemical-formula>
  <weight>553.7</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">2026-08-31T18:32:22Z</created-at>
  <updated-at type="dateTime">2026-08-31T18:32:22Z</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>CC1CC2C(CC1C)OC=C(C2=O)CN(C)CCN(C)CC3=CN(C4=CC=CC=C43)C5=CC=CC(=C5)C(F)(F)F</moldb-smiles>
  <moldb-formula>C32H38F3N3O2</moldb-formula>
  <moldb-inchi>InChI=1S/C32H38F3N3O2/c1-21-14-28-30(15-22(21)2)40-20-24(31(28)39)18-37(4)13-12-36(3)17-23-19-38(29-11-6-5-10-27(23)29)26-9-7-8-25(16-26)32(33,34)35/h5-11,16,19-22,28,30H,12-15,17-18H2,1-4H3</moldb-inchi>
  <moldb-inchikey>VVASHNNFTYICOG-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">553.291612</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>6.1</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>CHEM348177</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>6,7-dimethyl-3-[[methyl-[2-[methyl-[[1-[3-(trifluoromethyl)phenyl]indol-3-yl]methyl]amino]ethyl]amino]methyl]-4a,5,6,7,8,8a-hexahydrochromen-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 nil="true"/>
  <superklass nil="true"/>
  <klass nil="true"/>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0302574</sync-id>
  <structure-inchikey>VVASHNNFTYICOG-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>400000002c00000002000000000040000000000000000000000000000080000000020000000000000000000000000000080010100800000000010000000000000080000000000000000000020808000000002000000800000000000000000004400000000000000104000000000020100000020000004000000100001004040000000800000000000000040100000001104000000080000080000040800040400000004040000080000010040004000840000000000000020200000000000040000000100000000000000002000000000001000000200000000000000001040000000100040000000000000800001000000000000000040000000</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�� h� !h�!"h�"#h�"$�$%�$&amp;�$'���������h���h�#�h�B�������������	
������������������ !"#�����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:50:02Z</structure-indexed-at>
</compound>
