<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">288072</id>
  <title nil="true"/>
  <common-name>[3-[[2-(carboxymethoxy)benzoyl]amino]-2-methoxypropyl]mercury</common-name>
  <description>[3-[[2-(carboxymethoxy)benzoyl]amino]-2-methoxypropyl]mercury belongs to the phenoxyacetic acid derivatives, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the chemical formula C13H16HgNO5 and an average molecular weight of 466.86 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>10294</pubchem-id>
  <chemical-formula>C13H16HgNO5</chemical-formula>
  <weight>466.86</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">2026-08-28T00:49:44Z</created-at>
  <updated-at type="dateTime">2026-08-28T00:49:44Z</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>COC(CNC(=O)C1=CC=CC=C1OCC(=O)O)C[Hg]</moldb-smiles>
  <moldb-formula>C13H16HgNO5</moldb-formula>
  <moldb-inchi>InChI=1S/C13H16NO5.Hg/c1-9(18-2)7-14-13(17)10-5-3-4-6-11(10)19-8-12(15)16;/h3-6,9H,1,7-8H2,2H3,(H,14,17)(H,15,16);</moldb-inchi>
  <moldb-inchikey>JSYUKXVWRPINHC-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">468.073491</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>CHEM283965</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-[[2-(carboxymethoxy)benzoyl]amino]-2-methoxypropyl]mercury</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>Benzene and substituted derivatives</klass>
  <subklass>Phenoxyacetic acid derivatives</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0239839</sync-id>
  <structure-inchikey>JSYUKXVWRPINHC-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000000800000000004000000000000000004000000000000000000000000000000000000000000000004000000000000000000000002000800000000000000000000000002000000000020000000080100000000000000000000000000010000000040000000000000000000000000000000000000000000000000000040000000800020000000020080000000100100044000000000000000000000000400000001000000080000802000000081080000000000000000000000000000000000000000000000000000000000000000000000480200000000000000000000000000000040000000000400000000000020000100080200200000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������� ������`�������`�������h��������(�������(������@(������@h�������@h�������@h�������@h�������@(�������(�������`�������(�������(�������h��������`�����P (�������������������� ��(��� ��h��	h�	
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	�����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:01:14Z</structure-indexed-at>
</compound>
