<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">2572</id>
  <title>T3D2531</title>
  <common-name>Allopumiliotoxin</common-name>
  <description>Allopumiliotoxins are toxins found in poison dart frogs (genus Dendrobates). They are used a chemical defence against predators. (L1076)</description>
  <cas>73376-38-2</cas>
  <pubchem-id>5470308</pubchem-id>
  <chemical-formula>C16H29NO2</chemical-formula>
  <weight>267.219830</weight>
  <appearance>White powder.</appearance>
  <melting-point></melting-point>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility></solubility>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure>Injection (sting/bite)  (L1813) ; inhalation (smoking) (L1810)</route-of-exposure>
  <target nil="true"/>
  <mechanism-of-toxicity>Allopumiliotoxins may affect sodium and potassium channels in cells and inhibit calcium-dependent ATPase. (L1077, A313, A315)</mechanism-of-toxicity>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity>No indication of carcinogenicity to humans (not listed by IARC).</carcinogenicity>
  <use-source>Allopumiliotoxins are toxins found in poison dart frogs (genus Dendrobates). (L1076)</use-source>
  <min-risk-level nil="true"/>
  <health-effects>Allopumiliotoxins are neurotoxic and may also have effects on the cardiac system. (L1076)</health-effects>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2009-07-03T22:19:13Z</created-at>
  <updated-at type="dateTime">2014-12-24T20:25:40Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id></kegg-compound-id>
  <omim-id></omim-id>
  <chebi-id></chebi-id>
  <biocyc-id></biocyc-id>
  <ctd-id nil="true"/>
  <stitch-id>Allopumiliotoxin</stitch-id>
  <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>CCCCC(C)C=C1CN2CCCC2C(C)(O)C1O</moldb-smiles>
  <moldb-formula>C16H29NO2</moldb-formula>
  <moldb-inchi>InChI=1S/C16H29NO2/c1-4-5-7-12(2)10-13-11-17-9-6-8-14(17)16(3,19)15(13)18/h10,12,14-15,18-19H,4-9,11H2,1-3H3/b13-10-</moldb-inchi>
  <moldb-inchikey>InChIKey=LWXKAVPXEDNHLL-RAXLEYEMSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">267.407</moldb-average-mass>
  <moldb-mono-mass type="decimal">267.219829177</moldb-mono-mass>
  <origin>Exogenous</origin>
  <state>Solid</state>
  <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></synthesis-reference>
  <structure-image-caption nil="true"/>
</compound>
