<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">2573</id>
  <title>T3D2532</title>
  <common-name>Arenobufagin</common-name>
  <description>Arenobufagin is a cardiotoxic bufanolide steroid secreted by the Argentine toad (Bufo arenarum). It blocks the sodium/potassium pump in heart tissue. (L1078)</description>
  <cas>464-74-4</cas>
  <pubchem-id>10051</pubchem-id>
  <chemical-formula>C24H32O6</chemical-formula>
  <weight>416.219890</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)  (L1814) ; inhalation (smoking) (L1810)</route-of-exposure>
  <target nil="true"/>
  <mechanism-of-toxicity>Arenobufagin blocks the sodium/potassium pump in heart tissue. (L1078)</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>Arenobufagin is secreted by the Argentine toad (Bufo arenarum). (L1078)</use-source>
  <min-risk-level nil="true"/>
  <health-effects>Arenobufagin is cardiotoxic. (L1078)</health-effects>
  <symptoms>Symptoms include nausea, vomiting, anorexia, diarrhoea, abdominal pain, wild hallucinations, delirium, and severe headache. Depending on the severity the victim may later suffer irregular and slow pulse, tremors, various cerebral disturbances, especially of a visual nature, convulsions, and deadly disturbances of the heart such as heart block, brachycardia, or tachycardia. (L1078, L1084)</symptoms>
  <treatment nil="true"/>
  <created-at type="dateTime">2009-07-03T22:19:14Z</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>C055393</ctd-id>
  <stitch-id>Arenobufagin</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>CC12C(CCC1(O)C1CCC3CC(O)CCC3(C)C1C(O)C2=O)C1=COC(=O)C=C1</moldb-smiles>
  <moldb-formula>C24H32O6</moldb-formula>
  <moldb-inchi>InChI=1S/C24H32O6/c1-22-9-7-15(25)11-14(22)4-5-17-19(22)20(27)21(28)23(2)16(8-10-24(17,23)29)13-3-6-18(26)30-12-13/h3,6,12,14-17,19-20,25,27,29H,4-5,7-11H2,1-2H3</moldb-inchi>
  <moldb-inchikey>InChIKey=JGDCRWYOMWSTFC-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">416.5073</moldb-average-mass>
  <moldb-mono-mass type="decimal">416.219888756</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>
