<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">31063</id>
  <title nil="true"/>
  <common-name>(-)-Pinocamphone</common-name>
  <description>(-)-Pinocamphone belongs to the monoterpenoids, a subclass of prenol lipids within the organic compounds. It is classified as a lipid and lipid-like molecule with the formula C10H16O. The compound has an average molecular weight of 152.23 g/mol.</description>
  <cas>22339-21-5</cas>
  <pubchem-id nil="true"/>
  <chemical-formula>C10H16O</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">2016-05-26T01:32:44Z</created-at>
  <updated-at type="dateTime">2026-04-05T20:21:39Z</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>C[C@@H]1[C@@H]2C[C@H](CC1=O)C2(C)C</moldb-smiles>
  <moldb-formula>C10H16O</moldb-formula>
  <moldb-inchi>InChI=1S/C10H16O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-8H,4-5H2,1-3H3/t6-,7-,8+/m1/s1</moldb-inchi>
  <moldb-inchikey>MQPHVIPKLRXGDJ-PRJMDXOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">152.2334</moldb-average-mass>
  <moldb-mono-mass type="decimal">152.120115134</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>CHEM029958</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00085253</susdat-id>
  <iupac nil="true"/>
  <moldb-polar-surface-area>17.07</moldb-polar-surface-area>
  <moldb-refractivity>44.5396</moldb-refractivity>
  <moldb-polarizability>17.947534147214597</moldb-polarizability>
  <moldb-rotatable-bond-count>0</moldb-rotatable-bond-count>
  <moldb-acceptor-count>1</moldb-acceptor-count>
  <moldb-donor-count>0</moldb-donor-count>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic>-7.416966553301062</moldb-pka-strongest-basic>
  <moldb-physiological-charge>0</moldb-physiological-charge>
  <moldb-number-of-rings>2</moldb-number-of-rings>
  <moldb-alogps-logp>2.25</moldb-alogps-logp>
  <moldb-alogps-logs>-2.50</moldb-alogps-logs>
  <moldb-alogps-solubility>4.77e-01 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Lipids and lipid-like molecules</superklass>
  <klass>Prenol lipids</klass>
  <subklass>Monoterpenoids</subklass>
  <paper-count type="integer">294</paper-count>
  <sync-id>CED0013362</sync-id>
  <structure-inchikey>MQPHVIPKLRXGDJ-PRJMDXOYSA-N</structure-inchikey>
  <structure-fingerprint>1002000000000000000010000000000000008000020000000000000200000000000000002000000000000000000010080000400000000000000000000000020000000000000000000000000000000000000000000000000000000000000000000020000000000000000000000100000000048000000000000000000000002000000000000000000000000000020000800040000000000000800080000000000000000000000000000000000000000000000020000000000000000000000000000000000000000000000200000000000000000000000000000000000000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������ 4������� 4��������`������ 4��������`�������(�������(������� ������`�������`��������������������������������	��
�������B���������������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:10:28Z</structure-indexed-at>
</compound>
