<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">98648</id>
  <title nil="true"/>
  <common-name>1,5-Dimethyl-1-vinylhex-4-enyl heptanoate</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>16205250</pubchem-id>
  <chemical-formula>C17H30O2</chemical-formula>
  <weight nil="true"/>
  <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">2026-04-05T06:17:34Z</created-at>
  <updated-at type="dateTime">2026-04-05T06:17:34Z</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>CCCCCCC(=O)OC(C)(CCC=C(C)C)C=C</moldb-smiles>
  <moldb-formula>C17H30O2</moldb-formula>
  <moldb-inchi>InChI=1/C17H30O2/c1-6-8-9-10-13-16(18)19-17(5,7-2)14-11-12-15(3)4/h7,12H,2,6,8-11,13-14H2,1,3-5H3</moldb-inchi>
  <moldb-inchikey>APBQXTVQNYJPRE-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">266.425</moldb-average-mass>
  <moldb-mono-mass type="decimal">266.2245802</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <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 nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM094541</chemdb-id>
  <dsstox-id>DTXSID70992180</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00061252</susdat-id>
  <iupac nil="true"/>
  <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>Prenol lipids</klass>
  <subklass>Monoterpenoids</subklass>
  <paper-count type="integer">1</paper-count>
  <sync-id>CED0061545</sync-id>
  <structure-inchikey>APBQXTVQNYJPRE-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000002000010000000000000000000000010000000000000002000000000000000000000008804000000000000000000100000000000000000000000000010000000000000020000000000300000000000000000000000020010000000000000000000000000000000000000000000000000000400000000040000000000000000400010000000008000000000000000000401000000000080000000000000200002001000000000008000000000400000000000000000008020200008000000000040000000000000000000000000000000000010000000000000000000000000000010400400000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`�������`�������(�������(�������(������� ������`�������`�������`�������h��������(�������`�������`�������h��������h���������������������������(��� �	�	
�	����������������	������B��������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:38:18Z</structure-indexed-at>
</compound>
