101279 <common-name>Ethyl 5-(1,1-dimethylethyl)-a-methyl-2-oxocyclohexaneacetate</common-name> <description>Ethyl 5-(1,1-dimethylethyl)-a-methyl-2-oxocyclohexaneacetate belongs to the monoterpenoids, a subclass of prenol lipids within the organic compounds. This compound has the formula C15H26O3 and an average molecular weight of 254.37 g/mol. It is further classified under the superclass of lipids and lipid-like molecules.</description> <cas>94022-65-8</cas> <pubchem-id>44149659</pubchem-id> <chemical-formula>C15H26O3</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">2026-04-05T08:31:28Z</created-at> <updated-at type="dateTime">2026-04-05T08:31:28Z</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>CCOC(=O)C(C)C1CC(CCC1=O)C(C)(C)C</moldb-smiles> <moldb-formula>C15H26O3</moldb-formula> <moldb-inchi>InChI=1/C15H26O3/c1-6-18-14(17)10(2)12-9-11(15(3,4)5)7-8-13(12)16/h10-12H,6-9H2,1-5H3</moldb-inchi> <moldb-inchikey>ZOZQCTPXDUIFGG-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">254.37</moldb-average-mass> <moldb-mono-mass type="decimal">254.1881947</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>CHEM097172</chemdb-id> <dsstox-id>DTXSID30916660</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00064483</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>CED0146816</sync-id> <structure-inchikey>ZOZQCTPXDUIFGG-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000020800000002000000010000000000000000000000000010000001002000020000000000004200000800000000000000000000000000000000000000000000000400000000000000020000000000100000000000010000000000000010000000000000000000000000000020000000000000000000000100000000040000000008000000000000000000800000000000000020000000000000800000005000000000000080000000000000002800000008000000000000000000000000000000000200000002000000000000000002000200000000000000000002000000000000000000000000400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAASAAAAEgAAAIABBgBgAAAAAQMGAGAAAAAC AggAKAAAAAMCBgAoAAAAAwQIACgAAAADAgYAYAAAAAMBBgBgAAAAAQMGAGAA AAADAQYAYAAAAAICBgBgAAAAAwEGAGAAAAACAgYAYAAAAAICBgAoAAAAAwQI ACgAAAADAgYAIAAAAAQGAGAAAAABAwYAYAAAAAEDBgBgAAAAAQMLAAEAAQIA AgMgAwQoAgMFAAUGAAUHAAcIAAgJAAkKAAoLAAsMAAwNCAIJDgAODwAOEAAO EQAMBwBCAQAAAAYHDAsKCQgXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:39:44Z</structure-indexed-at> </compound>