<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">351852</id>
  <title nil="true"/>
  <common-name>[3-carboxy-2-(4-methyltricosanoyloxy)propyl]-trimethylazanium</common-name>
  <description>[3-carboxy-2-(4-methyltricosanoyloxy)propyl]-trimethylazanium is a chemical compound with the formula C31H62NO4+. With an average molecular weight of 512.80 g/mol, [3-carboxy-2-(4-methyltricosanoyloxy)propyl]-trimethylazanium is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>156961325</pubchem-id>
  <chemical-formula>C31H62NO4+</chemical-formula>
  <weight>512.8</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">2026-08-31T17:48:58Z</created-at>
  <updated-at type="dateTime">2026-08-31T17:48:58Z</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>CCCCCCCCCCCCCCCCCCCC(C)CCC(=O)OC(CC(=O)O)C[N+](C)(C)C</moldb-smiles>
  <moldb-formula>C31H62NO4+</moldb-formula>
  <moldb-inchi>InChI=1S/C31H61NO4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-28(2)24-25-31(35)36-29(26-30(33)34)27-32(3,4)5/h28-29H,6-27H2,1-5H3/p+1</moldb-inchi>
  <moldb-inchikey>FITGDRLSSQKCQE-UHFFFAOYSA-O</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">512.4678845</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>11.1</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>CHEM347745</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>[3-carboxy-2-(4-methyltricosanoyloxy)propyl]-trimethylazanium</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>CED0302150</sync-id>
  <structure-inchikey>FITGDRLSSQKCQE-UHFFFAOYSA-O</structure-inchikey>
  <structure-fingerprint>40000000000000000400800000000004000000000000000000000000000000000000001002000003000000000000000004000002000000000000000000000000000000000000000400010100000008000020000000000100000000001000100000000020010000000000000000080000000000000000000000000800000000000000000040000000000000000000070000000000000000000000008000000000102000000000000000000000002000000000000048000000000000000000000000000008000000000000100000000000000000000002000000400000000000000000000000000000020000000000010400000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������$���#���€���`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������(�������(�������(�������`�������`�������(�������(�������h��������`������ "�������`�������`�������`�������������������������������	�	
�
��������������������������������������(��� �����������(��� ���� � !� "� #�B��������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:49:43Z</structure-indexed-at>
</compound>
