<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">4905</id>
  <title>T3D4850</title>
  <common-name>Propyl gallate</common-name>
  <description>Propyl gallate is found in corn. Propyl gallate is an antioxidant used in foods especially animal fats and vegetable oils. Synergistic with other antioxidants such as Butylated hydroxyanisole &lt;ht&gt;DNB28-K&lt;/ht&gt; and 2,6-Di-tert-butyl-4-methylphenol &lt;ht&gt;HCH42-H&lt;/ht&gt;. Especially effective with polyunsaturated fats. Indirect food additive arising from paper or board packaging, adhesives and food contact polymers Propyl gallate is an anti-oxidant. It protects against oxidation by hydrogen peroxide and oxygen free radicals, in a catalytic manner similar to superoxide dismutase. Propyl gallate, or propyl 3,4,5-trihydroxybenzoate is an ester formed by the condensation of gallic acid and propanol. It is an antioxidant added to foods containing oils and fats to prevent oxidation.[citation needed] As a food additive, it is used under the E number E310.

Propyl gallate has been shown to exhibit pro-oxidant and radical scavenger functions (A7908, A7909).</description>
  <cas>121-79-9</cas>
  <pubchem-id>4947</pubchem-id>
  <chemical-formula>C10H12O5</chemical-formula>
  <weight nil="true"/>
  <appearance>White powder.</appearance>
  <melting-point>150 °C</melting-point>
  <boiling-point>Decomposes</boiling-point>
  <density nil="true"/>
  <solubility>3.5 mg/mL at 25 °C</solubility>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure></route-of-exposure>
  <target nil="true"/>
  <mechanism-of-toxicity></mechanism-of-toxicity>
  <metabolism></metabolism>
  <toxicity></toxicity>
  <lethaldose></lethaldose>
  <carcinogenicity>No indication of carcinogenicity to humans (not listed by IARC).</carcinogenicity>
  <use-source></use-source>
  <min-risk-level></min-risk-level>
  <health-effects></health-effects>
  <symptoms></symptoms>
  <treatment></treatment>
  <created-at type="dateTime">2014-09-11T05:19:10Z</created-at>
  <updated-at type="dateTime">2014-12-24T20:26:58Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia>http://en.wikipedia.org/wiki/Propyl_3,4,5-trihydroxybenzoate</wikipedia>
  <uniprot-id></uniprot-id>
  <kegg-compound-id>C11155</kegg-compound-id>
  <omim-id></omim-id>
  <chebi-id nil="true"/>
  <biocyc-id></biocyc-id>
  <ctd-id>D011435</ctd-id>
  <stitch-id></stitch-id>
  <drugbank-id nil="true"/>
  <pdb-id></pdb-id>
  <actor-id></actor-id>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>CCCOC(=O)C1=CC(O)=C(O)C(O)=C1</moldb-smiles>
  <moldb-formula>C10H12O5</moldb-formula>
  <moldb-inchi>InChI=1S/C10H12O5/c1-2-3-15-10(14)6-4-7(11)9(13)8(12)5-6/h4-5,11-13H,2-3H2,1H3</moldb-inchi>
  <moldb-inchikey>InChIKey=ZTHYODDOHIVTJV-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">212.1993</moldb-average-mass>
  <moldb-mono-mass type="decimal">212.068473494</moldb-mono-mass>
  <origin>Exogenous</origin>
  <state>Solid</state>
  <logp>1.80</logp>
  <hmdb-id>HMDB33835</hmdb-id>
  <chembl-id>CHEMBL7983</chembl-id>
  <chemspider-id>4778</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>
