<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">10961</id>
  <title nil="true"/>
  <common-name>Magnetite</common-name>
  <description nil="true"/>
  <cas>1309-38-2</cas>
  <pubchem-id>27284</pubchem-id>
  <chemical-formula>Fe</chemical-formula>
  <weight>55.84</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">2016-05-19T03:12:20Z</created-at>
  <updated-at type="dateTime">2026-05-14T19:42:42Z</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>DB14510</drugbank-id>
  <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>[Fe++]</moldb-smiles>
  <moldb-formula>Fe</moldb-formula>
  <moldb-inchi>InChI=1S/Fe/q+2</moldb-inchi>
  <moldb-inchikey>CWYNVVGOOAEACU-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">55.845</moldb-average-mass>
  <moldb-mono-mass type="decimal">55.934942133</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-0.77</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>CHEM009856</chemdb-id>
  <dsstox-id>DTXSID2052780</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00078787</susdat-id>
  <iupac>lambda2-iron(2+) ion</iupac>
  <moldb-polar-surface-area>0.0</moldb-polar-surface-area>
  <moldb-refractivity>0.0</moldb-refractivity>
  <moldb-polarizability>1.7784</moldb-polarizability>
  <moldb-rotatable-bond-count>0</moldb-rotatable-bond-count>
  <moldb-acceptor-count>0</moldb-acceptor-count>
  <moldb-donor-count>0</moldb-donor-count>
  <moldb-pka-strongest-acidic>4.58</moldb-pka-strongest-acidic>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge>2</moldb-physiological-charge>
  <moldb-number-of-rings>0</moldb-number-of-rings>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Inorganic compounds</kingdom>
  <superklass>Homogeneous metal compounds</superklass>
  <klass>Homogeneous transition metal compounds</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
</compound>
