<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">309854</id>
  <title nil="true"/>
  <common-name>6-(2-octylcyclopropyl)hexanoic acid</common-name>
  <description>6-(2-octylcyclopropyl)hexanoic acid is a compound with the formula C17H32O2. It has an average molecular weight of 268.40 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>86087233</pubchem-id>
  <chemical-formula>C17H32O2</chemical-formula>
  <weight>268.4</weight>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <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 nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2026-08-29T04:32:49Z</created-at>
  <updated-at type="dateTime">2026-08-29T04:32:49Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <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>CCCCCCCCC1CC1CCCCCC(=O)O</moldb-smiles>
  <moldb-formula>C17H32O2</moldb-formula>
  <moldb-inchi>InChI=1S/C17H32O2/c1-2-3-4-5-6-8-11-15-14-16(15)12-9-7-10-13-17(18)19/h15-16H,2-14H2,1H3,(H,18,19)</moldb-inchi>
  <moldb-inchikey>FMVHABNRCKPNEA-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">268.2402303</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>6.1</logp>
  <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 nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM305747</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>6-(2-octylcyclopropyl)hexanoic acid</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Lipids and lipid-like molecules</superklass>
  <klass>Fatty Acyls</klass>
  <subklass>Fatty acids and conjugates</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0260839</sync-id>
  <structure-inchikey>FMVHABNRCKPNEA-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000000000000000000000000000000000200000000000000002000000000200000000000004000000000000000000000000000000000000000000000000010000000000000020000000000000000000000000000000000020010000008000000000000000110000020000000000000000000000100000000040000000000002000000010000000000000000000000000000001000010800000000000000000000000000000000000008000000000000000000000000000008000000000000000000000000000000000000000000400000000000000000000000000000000000000000010400000000000000010000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>40000020010206000800000001002000000000000105200000300040020000044002000000800000000001000080000004200084000c10010000643000a00000c4110000000000000080102000620100000000004000001254000432100009000c200000004002000000000844300000200080500004600411080000021000020044000804400008080202088808000811140002444014020004080010400000004100000010c000000008400164251002c0000008010800000000000040020000000004040000000080000000000200000000000200400009000000080000000000080000000000000000000000200000100010804000000000000050000000</structure-pattern-fingerprint>
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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:17:25Z</structure-indexed-at>
</compound>
