<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">309354</id>
  <title nil="true"/>
  <common-name>1-(2,2,3,7-tetramethyl-4-tricyclo[5.2.2.01,6]undec-3-enyl)ethanone</common-name>
  <description>1-(2,2,3,7-tetramethyl-4-tricyclo[5.2.2.01,6]undec-3-enyl)ethanone is a chemical compound with the formula C17H26O. It has an average molecular weight of 246.40 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>122550</pubchem-id>
  <chemical-formula>C17H26O</chemical-formula>
  <weight>246.4</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">2026-08-29T03:50:27Z</created-at>
  <updated-at type="dateTime">2026-08-29T03:50:27Z</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>CC1=C(CC2C3(CCC2(C1(C)C)CC3)C)C(=O)C</moldb-smiles>
  <moldb-formula>C17H26O</moldb-formula>
  <moldb-inchi>InChI=1S/C17H26O/c1-11-13(12(2)18)10-14-16(5)6-8-17(14,9-7-16)15(11,3)4/h14H,6-10H2,1-5H3</moldb-inchi>
  <moldb-inchikey>NVCKBQXBWJYISN-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">246.1983654</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.3</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>CHEM305247</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>1-(2,2,3,7-tetramethyl-4-tricyclo[5.2.2.01,6]undec-3-enyl)ethanone</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>Prenol lipids</klass>
  <subklass>Monoterpenoids</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0260351</sync-id>
  <structure-inchikey>NVCKBQXBWJYISN-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>80000000000100200000000000000000000200000000000000000000000000000000000202000000000000000000000000000000000000000000200000000000000000000000000000000000000100000000000000000000000000040200000000000000000000185000000000480000000000000000000000002000000000000000000000000000200000000000000080000001010a0000000000000000000000000000000000000000000000000200000000000000002000000000000001102000000000000000000000000800000000000000000000000400000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������(�������(�������`�������`������� ������`�������`������� ������ ������`�������`�������`�������`�������`�������(�������(�������`�����������(��������������������	�	
�	������������ ��(����	�������B������	�������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:17:04Z</structure-indexed-at>
</compound>
