130020 <common-name>9-Octadecenoic acid (9Z)-, (2-hydroxy-1,3,2-dioxaborolan-4-yl)methyl</common-name> <description>9-Octadecenoic acid (9Z)-, (2-hydroxy-1,3,2-dioxaborolan-4-yl)methyl belongs to the fatty acid esters, a subclass of fatty acyls within the organic compounds. This lipid-like molecule has the chemical formula C21H39B1O5 and an average molecular weight of 382.30 g/mol.</description> <cas>89325-22-4</cas> <pubchem-id>6441996</pubchem-id> <chemical-formula>C21H39B1O5</chemical-formula> <weight>382.3</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">2026-04-06T13:47:53Z</created-at> <updated-at type="dateTime">2026-08-30T09:40:00Z</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>B1(OCC(O1)COC(=O)CCCCCCC/C=C\CCCCCCCC)O</moldb-smiles> <moldb-formula>C21H39B1O5</moldb-formula> <moldb-inchi>InChI=1S/C21H39BO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)25-18-20-19-26-22(24)27-20/h9-10,20,24H,2-8,11-19H2,1H3/b10-9-</moldb-inchi> <moldb-inchikey>XBSXRZOJVFMYRV-KTKRTIGZSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">382.2890548</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>CHEM125913</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00126553</susdat-id> <iupac>(2-hydroxy-1,3,2-dioxaborolan-4-yl)methyl (Z)-octadec-9-enoate</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>Fatty Acyls</klass> <subklass>Fatty acid esters</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0179618</sync-id> <structure-inchikey>XBSXRZOJVFMYRV-KTKRTIGZSA-N</structure-inchikey> <structure-fingerprint>c00000000000000010000000000000000000000000000000000002000000000000000001000000004000000000000000000000000000000000000000000000010000000000000020800004000300000000000000000001000020110000000000000000000000000000020000000000000000000000100000000040800000000000000000810000000000000000000000080000001000000000000000080000081000002101000000000088000200000000080000000000000008000000000000000000000000000000000000202000000010000000000040000000000000000000000000010410000000000000000000000000000000</structure-fingerprint> 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KAIHCQAJCgAKCwALDAAMDQANDgAODwAPEAQEEBEKAgICDxIREgQDEhMAExQA FBUAFRYAFhcAFxgAGBkAABoABAAAQgEAAAAFAAECAwQXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:48:44Z</structure-indexed-at> </compound>