100132 <common-name>1,3,3-Trimethylspiro[bicyclo[2.2.1]heptane-2,2'-[2H]pyran]-4'(3'H)-one</common-name> <description>1,3,3-Trimethylspiro[bicyclo[2.2.1]heptane-2,2'-[2H]pyran]-4'(3'H)-one belongs to the monoterpenoids, a subclass of prenol lipids within the organic compounds. This lipid-like molecule has the chemical formula C14H20O2 and an average molecular weight of 220.31 g/mol.</description> <cas>93777-36-7</cas> <pubchem-id>44147994</pubchem-id> <chemical-formula>C14H20O2</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">2026-04-05T07:28:39Z</created-at> <updated-at type="dateTime">2026-04-05T07:28:39Z</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>CC12CCC(C1)C(C)(C)C21CC(=O)C=CO1</moldb-smiles> <moldb-formula>C14H20O2</moldb-formula> <moldb-inchi>InChI=1/C14H20O2/c1-12(2)10-4-6-13(3,8-10)14(12)9-11(15)5-7-16-14/h5,7,10H,4,6,8-9H2,1-3H3</moldb-inchi> <moldb-inchikey>NKHUZICKJDIEGB-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">220.312</moldb-average-mass> <moldb-mono-mass type="decimal">220.1463299</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>CHEM096025</chemdb-id> <dsstox-id>DTXSID90918069</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00063122</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">0</paper-count> <sync-id>CED0088505</sync-id> <structure-inchikey>NKHUZICKJDIEGB-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20000000000000000000000008000000000000020001000000000000020000000000008010040000000000000010000000000000004000080001000040200000000000000000020800001000000000000000000000800000000000000000000000000000000000000020008000000000000080000100000000048000000000000000000000000200000000000000000000000200020000000000004000000000000080000000000000000000000000000000000000000000000000000100000008000000000000000000000000000000008000000000000000000000000000040000000000000000000000000000000000000000004</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAAEgAAAIABBgBgAAAAAQMGACAAAAAE BgBgAAAAAgIGAGAAAAACAgYAYAAAAAMBBgBgAAAAAgIGACAAAAAEBgBgAAAA AQMGAGAAAAABAwYAIAAAAAQGAGAAAAACAgYAKAAAAAMECAAoAAAAAwIGAGgA AAADAwEGAGgAAAADAwEIACgAAAADAgsAAQABAgACAwADBAAEBQAEBgAGBwAG CAAGCQAJCgAKCwALDCgCCw0gDQ4oAg4PIAUBAA8JAAkBAEIDAAAABQIBBQQD BQUEBgkBBgoLDQ4PCRcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:39:06Z</structure-indexed-at> </compound>