<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">336700</id>
  <title nil="true"/>
  <common-name>1-[1-(3,4-dimethoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-3-(methylamino)propan-2-ol</common-name>
  <description>1-[1-(3,4-dimethoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-3-(methylamino)propan-2-ol is a chemical compound with the formula C23H29N3O3. It has an average molecular weight of 395.50 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>3066741</pubchem-id>
  <chemical-formula>C23H29N3O3</chemical-formula>
  <weight>395.5</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">2026-08-30T19:14:44Z</created-at>
  <updated-at type="dateTime">2026-08-30T19:14:44Z</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>CNCC(CN1CCC2=C(C1C3=CC(=C(C=C3)OC)OC)NC4=CC=CC=C24)O</moldb-smiles>
  <moldb-formula>C23H29N3O3</moldb-formula>
  <moldb-inchi>InChI=1S/C23H29N3O3/c1-24-13-16(27)14-26-11-10-18-17-6-4-5-7-19(17)25-22(18)23(26)15-8-9-20(28-2)21(12-15)29-3/h4-9,12,16,23-25,27H,10-11,13-14H2,1-3H3</moldb-inchi>
  <moldb-inchikey>CSGKMGCBTWWWIK-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">395.2208918</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.5</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>CHEM332593</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>1-[1-(3,4-dimethoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-3-(methylamino)propan-2-ol</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>Alkaloids and derivatives</superklass>
  <klass>Harmala alkaloids</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0287158</sync-id>
  <structure-inchikey>CSGKMGCBTWWWIK-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000000900200000100000800000000000000000000100000400000000000000000000000000040000000000000000000000000010000000000000000000000000000000002000000002000000000000100000040000000000000000000010000000040000000100000000000024100800000002000000000100000000040000040800000200000000080000000000100000000000400000001000010000000000000040100080000000000120000000000008000000000000080000000040000000000000001000000000000000000000000204200404001000010010000000000000040000000000020000000000020080010000002000200</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ�������������������� ���€���`�������`�������`�������`�������`������� ������`�������`������@(������@(�������`������@(������@h�������@(������@(������@h�������@h��������(�������`�������(�������`������@8�������@(������@h�������@h�������@h�������@h�������@(�������`�������������������������������	h�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:38:01Z</structure-indexed-at>
</compound>
