<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">47</id>
  <title>T3D0046</title>
  <common-name>Heptachlor epoxide</common-name>
  <description>Heptachlor epoxide is a chemical produced when heptachlor is broken down by bacteria and animals. Heptachlor is a manufactured cyclodiene organochlorine insecticide. As it is a persistant organic pollutant, heptachlor use is banned or limited in most areas. The epoxide is more likely to be found in the environment than heptachlor. (L118, L119)</description>
  <cas>1024-57-3</cas>
  <pubchem-id>13930</pubchem-id>
  <chemical-formula>C10H5Cl7O</chemical-formula>
  <weight>385.816010</weight>
  <appearance>White powder.</appearance>
  <melting-point>160°C</melting-point>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility>0.0002 mg/mL at 25 °C [BIGGAR,JW &amp; RIGGS,RI (1974)]</solubility>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure>Oral (L118) ; inhalation (L118) ; dermal (L118)</route-of-exposure>
  <target nil="true"/>
  <mechanism-of-toxicity>Heptachlor epoxide is a central nervous system stimulant. It non-competitively blocks neurotransmitter action at gamma-amino butyric acid receptors, resulting in overstimulation of the nervous system. Heptachlor epoxide is also believed to exert carcinogenic effects by activating key kinases in signalling pathways and inhibiting apoptosis. (L118, A81, A82)</mechanism-of-toxicity>
  <metabolism>Heptachlor epoxide is readily absorbed by the skin, lungs and gastrointestinal tract and excreted in the urine and faeces. (L118)</metabolism>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity>No indication of carcinogenicity (not listed by IARC). (L135)</carcinogenicity>
  <use-source>Heptachlor epoxide is a chemical produced when heptachlor is broken down by bacteria and animals. Heptachlor was originally widely produced as an insecticide, but is now used only in fire and control in underground transformers. (L118)</use-source>
  <min-risk-level nil="true"/>
  <health-effects>Exposure to heptachlor epoxide may cause damage to liver, nervous system, and immune system. (L118)</health-effects>
  <symptoms>Heptachlor epoxide poisoning may cause convulsions, vomiting, seizures, confusion, incoordination, excitability, coma, hypotension, and respiratory failure. (L118)</symptoms>
  <treatment>Treatment is symptomatic and is aimed at controlling convulsions, coma, and respiratory depression. (L118) </treatment>
  <created-at type="dateTime">2009-03-06T18:57:59Z</created-at>
  <updated-at type="dateTime">2014-12-24T20:20:58Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id>C14327</kegg-compound-id>
  <omim-id></omim-id>
  <chebi-id>25520</chebi-id>
  <biocyc-id></biocyc-id>
  <ctd-id>D006534</ctd-id>
  <stitch-id>Heptachlor epoxide</stitch-id>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id>6458</actor-id>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>ClC1C2OC2C2C1C1(Cl)C(Cl)=C(Cl)C2(Cl)C1(Cl)Cl</moldb-smiles>
  <moldb-formula>C10H5Cl7O</moldb-formula>
  <moldb-inchi>InChI=1S/C10H5Cl7O/c11-3-1-2(4-5(3)18-4)9(15)7(13)6(12)8(1,14)10(9,16)17/h1-5H</moldb-inchi>
  <moldb-inchikey>InChIKey=ZXFXBSWRVIQKOD-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">389.317</moldb-average-mass>
  <moldb-mono-mass type="decimal">385.816008731</moldb-mono-mass>
  <origin>Exogenous</origin>
  <state>Solid</state>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id>CHEMBL1903207</chembl-id>
  <chemspider-id>13328</chemspider-id>
  <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></synthesis-reference>
  <structure-image-caption nil="true"/>
</compound>
