354577 <common-name>2-[hydroxy-[(e,2s,3r)-3-hydroxy-2-(tetradecanoylamino)octadec-4-enoxy]phosphoryl]oxyethyl-trimethylazanium</common-name> <description>2-[hydroxy-[(e,2s,3r)-3-hydroxy-2-(tetradecanoylamino)octadec-4-enoxy]phosphoryl]oxyethyl-trimethylazanium is a chemical compound with the formula C37H76N2O6P+. With an average molecular weight of 676.00 g/mol, 2-[hydroxy-[(e,2s,3r)-3-hydroxy-2-(tetradecanoylamino)octadec-4-enoxy]phosphoryl]oxyethyl-trimethylazanium is a heavy molecule.</description> <cas nil="true"/> <pubchem-id>11433863</pubchem-id> <chemical-formula>C37H76N2O6P+</chemical-formula> <weight>676</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">2026-08-31T22:14:16Z</created-at> <updated-at type="dateTime">2026-08-31T22:14:16Z</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>CCCCCCCCCCCCCC=CC(C(COP(=O)(O)OCC[N+](C)(C)C)NC(=O)CCCCCCCCCCCCC)O</moldb-smiles> <moldb-formula>C37H76N2O6P+</moldb-formula> <moldb-inchi>InChI=1S/C37H75N2O6P/c1-6-8-10-12-14-16-18-19-21-22-24-26-28-30-36(40)35(34-45-46(42,43)44-33-32-39(3,4)5)38-37(41)31-29-27-25-23-20-17-15-13-11-9-7-2/h28,30,35-36,40H,6-27,29,31-34H2,1-5H3,(H-,38,41,42,43)/p+1/b30-28+/t35-,36+/m0/s1</moldb-inchi> <moldb-inchikey>KYICBZWZQPCUMO-PSALXKTOSA-O</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">675.5441002</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>11.3</logp> <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>CHEM350470</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>2-[hydroxy-[(e,2s,3r)-3-hydroxy-2-(tetradecanoylamino)octadec-4-enoxy]phosphoryl]oxyethyl-trimethylazanium</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>Sphingolipids</klass> <subklass>Phosphosphingolipids</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0304858</sync-id> <structure-inchikey>KYICBZWZQPCUMO-UHFFFAOYSA-O</structure-inchikey> <structure-fingerprint>400400000040000000008000000006000000000000000000800000001000000000800000020000010000000000000000000040020000000000000000020000000000000000000000100100000000080000200000000003000000000000000000010000200110000000000000002000218000400000000000000008000000000000200000400000000000000000000100800000000000000000000000000010000000020000000000000880000000010000000000880000000000000000000000002000080200000000000080000000000000000000000a0000000000000080000000000000020000000000000000010400000000000000000100000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAuAAAALQAAAIABBgBgAAAAAQMGAGAAAAAC AgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgIGAGAA AAACAgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgIG AGgAAAADAwEGAGgAAAADAwEGAGAAAAADAQYAYAAAAAMBBgBgAAAAAgIIACAA AAACDwAgAAAABQgAKAAAAAMCCABgAAAAAQEIACAAAAACBgBgAAAAAgIGAGAA AAACAgcgIgAAAAEEBgBgAAAAAQMGAGAAAAABAwYAYAAAAAEDBwBoAAAAAwIB BgAoAAAAAwQIACgAAAADAgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAA AAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYA YAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAEDCABgAAAAAQELAAEAAQIA AgMAAwQABAUABQYABgcABwgACAkACQoACgsACwwADA0ADQ4IAg4PAA8QABAR ABESABITABMUCAITFQATFgAWFwAXGAAYGQAZGgAZGwAZHAAQHQAdHiAeHygC HiAAICEAISIAIiMAIyQAJCUAJSYAJicAJygAKCkAKSoAKisAKywADy0AQgAA AAAXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:52:31Z</structure-indexed-at> </compound>