315300 <common-name>[[(z)-4-ethoxy-4-oxobut-2-en-2-yl]oxy-propan-2-yloxyalumanyl] octadecanoate</common-name> <description>[(z)-4-ethoxy-4-oxobut-2-en-2-yl]oxy-propan-2-yloxyalumanyl] octadecanoate is a chemical compound with the formula C27H51AlO6. It has an average molecular weight of 498.70 g/mol.</description> <cas>68318-47-8</cas> <pubchem-id>90684544</pubchem-id> <chemical-formula>C27H51AlO6</chemical-formula> <weight>498.7</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">2026-08-29T12:39:21Z</created-at> <updated-at type="dateTime">2026-08-29T12:39:21Z</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>CCCCCCCCCCCCCCCCCC(=O)O[Al](OC(C)C)OC(=CC(=O)OCC)C</moldb-smiles> <moldb-formula>C27H51AlO6</moldb-formula> <moldb-inchi>InChI=1S/C18H36O2.C6H10O3.C3H7O.Al/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-3-9-6(8)4-5(2)7;1-3(2)4;/h2-17H2,1H3,(H,19,20);4,7H,3H2,1-2H3;3H,1-2H3;/q;;-1;+3/p-2/b;5-4-;;</moldb-inchi> <moldb-inchikey>WCNJWMFBCYTSDB-ZGVDEOGJSA-L</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">498.3501028</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>CHEM311193</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>[[(z)-4-ethoxy-4-oxobut-2-en-2-yl]oxy-propan-2-yloxyalumanyl] octadecanoate</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" nil="true"/> <sync-id>CED0266169</sync-id> <structure-inchikey>WCNJWMFBCYTSDB-UHFFFAOYSA-L</structure-inchikey> <structure-fingerprint>4000000000000000000080000000000000001000000000000000000000000000000000100a000000004000000040020000000000000000000000000000000000000006000000000000010000000000000020000000000300000000000000000000000020010100000000000000000000000000000000000000000000000000400000000040004000000004008000010000000000000000000000020000001000000000000000100000000000002101000000000208000000000000000000000000000008004000000000000000000000080000000000002000000000000000000000000000000400000020000000010400000000000000200000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAiAAAAIQAAAIABBgBgAAAAAQMGAGAAAAAC AgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgIGAGAA AAACAgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgIG AGAAAAACAgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAKAAAAAMECAAoAAAA AwIIACgAAAADAg0gKAAAAAMDCAAgAAAAAgYAYAAAAAMBBgBgAAAAAQMGAGAA AAABAwgAKAAAAAMCBgAoAAAAAwQGAGgAAAADAwEGACgAAAADBAgAKAAAAAMC CAAoAAAAAwIGAGAAAAACAgYAYAAAAAEDBgBgAAAAAQMLAAEAAQIAAgMAAwQA BAUABQYABgcABwgACAkACQoACgsACwwADA0ADQ4ADg8ADxAAEBEAERIoAhET IBMUABQVABUWABYXABYYABQZABkaIBobKAIbHCAcHSgCHB4gHh8AHyAAGiEA QgAAAAAXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:21:34Z</structure-indexed-at> </compound>