<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">337381</id>
  <title nil="true"/>
  <common-name>Trimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propoxy]ethyl]azanium</common-name>
  <description>Trimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propoxy]ethyl]azanium is a compound with the formula C23H34NO2+. It has an average molecular weight of 356.50 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>18541</pubchem-id>
  <chemical-formula>C23H34NO2+</chemical-formula>
  <weight>356.5</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">2026-08-30T20:11:59Z</created-at>
  <updated-at type="dateTime">2026-08-30T20:11:59Z</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>C[N+](C)(C)CCOCC(CC1CCCO1)CC2=CC=CC3=CC=CC=C32</moldb-smiles>
  <moldb-formula>C23H34NO2+</moldb-formula>
  <moldb-inchi>InChI=1S/C23H34NO2/c1-24(2,3)13-15-25-18-19(17-22-11-7-14-26-22)16-21-10-6-9-20-8-4-5-12-23(20)21/h4-6,8-10,12,19,22H,7,11,13-18H2,1-3H3/q+1</moldb-inchi>
  <moldb-inchikey>YHCVZNGZHXNNOK-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">356.2589543</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.4</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>CHEM333274</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>Trimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propoxy]ethyl]azanium</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>Benzenoids</superklass>
  <klass>Naphthalenes</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0287821</sync-id>
  <structure-inchikey>YHCVZNGZHXNNOK-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>400400000000000000018000000802000000000000000000000000000000008000000000000000010000000000400000000000120000000000000000000000000000000000000010000000000000080000408000000001000000000000000000000000002000040000000000000000000000400200000a0000000000000000100821000040000001800080000000000000000000000100000000000000000000000000000004000004048000080100000008000000000008000000000000000000010000040000040000008000000000020000000000020000000200000000000000000000000001000041000000000000000000000000000080000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������ "�������`�������`�������`�������`������� ������`�������`�������`�������`�������`�������`�������`������� ������`������@(������@h�������@h�������@h�������@(������@h�������@h�������@h�������@h�������@(�������������������������������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:38:31Z</structure-indexed-at>
</compound>
