<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">291428</id>
  <title nil="true"/>
  <common-name>(ne)-n-[[1-[[3-[(e)-hydroxyiminomethyl]pyridin-1-ium-1-yl]methoxymethyl]pyridin-1-ium-4-yl]methylidene]hydroxylamine</common-name>
  <description>(ne)-n-[[1-[[3-[(e)-hydroxyiminomethyl]pyridin-1-ium-1-yl]methoxymethyl]pyridin-1-ium-4-yl]methylidene]hydroxylamine is a compound with the formula C14H16N4O3+2. It has an average molecular weight of 288.30 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>135959460</pubchem-id>
  <chemical-formula>C14H16N4O3+2</chemical-formula>
  <weight>288.3</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">2026-08-28T06:15:30Z</created-at>
  <updated-at type="dateTime">2026-08-28T06:15:30Z</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>C1=CC(=C[N+](=C1)COC[N+]2=CC=C(C=C2)C=NO)C=NO</moldb-smiles>
  <moldb-formula>C14H16N4O3+2</moldb-formula>
  <moldb-inchi>InChI=1S/C14H14N4O3/c19-15-8-13-3-6-17(7-4-13)11-21-12-18-5-1-2-14(10-18)9-16-20/h1-10H,11-12H2/p+2/b16-9+</moldb-inchi>
  <moldb-inchikey>DEAFPMPKAOVYED-CXUHLZMHSA-P</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">288.1222404</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.1</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>CHEM287321</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>(ne)-n-[[1-[[3-[(e)-hydroxyiminomethyl]pyridin-1-ium-1-yl]methoxymethyl]pyridin-1-ium-4-yl]methylidene]hydroxylamine</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>CED0243001</sync-id>
  <structure-inchikey>DEAFPMPKAOVYED-UHFFFAOYSA-P</structure-inchikey>
  <structure-fingerprint>800000000000000000040000000000000000000000000002000000000000008001020000000010000000000000000001000000000000000000000000000000000000000000000000000000000300000004000000000000000000010400000004000080080000000000000000000000000000001000000000000000800000800000800000000000004000000000000000200000000000000000000000000000400000080000000000000000000000000000000000000080000000000000000000000000000000000802000000000000000200000200000000000000000000000040000000001000000000000000000080000000004000</structure-fingerprint>
  <structure-pattern-fingerprint>403080000102024000000900010820000000040000052000003120620200010c4002201000800000000041000280000004200024408c30010020643000a00000c6110c00020200000080100000620000000501904001013242000422000041000c2004040040020000400400c41400002000807009018004193808000251000a004800880ce0800808020200082c0008113c0812440014820000080000400020004310000010c00000000840016c25100ac00000884108401000000000c00210000000040400020201800000040102800000000002004000090001000800010000000000000900040000001040032000001000308042000e0000000070000000</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€��@h�������@h�������@(������@h�������`*�������@h��������`������� ������`������`*�������@h�������@h�������@(������@h�������@h��������h��������(�������h��������h��������(�������h���������h���h���h���h���h�����������	�	
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���	����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:03:47Z</structure-indexed-at>
</compound>
