<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">4666</id>
  <title>T3D4612</title>
  <common-name>Heptadecanoic acid</common-name>
  <description>Heptadecanoic acid is a fatty acid of exogenous (primarily ruminant) origin. Many 'odd' length long chain amino acids are derived from the consumption of dairy fats (milk and meat). Heptadecanoic acid constitutes 0.61% of milk fat and 0.83% of ruminant meat fat. The content of heptadecanoic acid in the subcutaneous adipose tissue of humans appears to be a good biological marker of long-term milk fat intake in free-living individuals in populations with high consumption of dairy products. (A3688).</description>
  <cas>506-12-7</cas>
  <pubchem-id>10465</pubchem-id>
  <chemical-formula>C17H34O2</chemical-formula>
  <weight>270.5</weight>
  <appearance>White powder.</appearance>
  <melting-point>61.3 °C</melting-point>
  <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>No indication of carcinogenicity to humans (not listed by IARC).</carcinogenicity>
  <use-source>This is an endogenously produced metabolite found in the human body. It is used in metabolic reactions, catabolic reactions or waste generation.</use-source>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2014-09-05T17:13:54Z</created-at>
  <updated-at type="dateTime">2026-04-17T17:22:14Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id>32365</chebi-id>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <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>CCCCCCCCCCCCCCCCC(O)=O</moldb-smiles>
  <moldb-formula>C17H34O2</moldb-formula>
  <moldb-inchi>InChI=1S/C17H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h2-16H2,1H3,(H,18,19)</moldb-inchi>
  <moldb-inchikey>KEMQGTRYUADPNZ-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">270.4507</moldb-average-mass>
  <moldb-mono-mass type="decimal">270.255880332</moldb-mono-mass>
  <origin>Endogenous</origin>
  <state>Solid</state>
  <logp nil="true"/>
  <hmdb-id>HMDB02259</hmdb-id>
  <chembl-id>CHEMBL1172910</chembl-id>
  <chemspider-id>10033</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>Heiduschka, A.; Ripper, J.  Heptadecylic acid.    Berichte der Deutschen Chemischen Gesellschaft [Abteilung] B: Abhandlungen  (1923),  56B  1736-9.</synthesis-reference>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM003572</chemdb-id>
  <dsstox-id>DTXSID5021596</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00019727</susdat-id>
  <iupac>heptadecanoic acid</iupac>
</compound>
