304388 <common-name>[3-carboxy-2-[3-[(2-hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl)amino]propanoyloxy]propyl]-trimethylazanium</common-name> <description>[3-carboxy-2-[3-[(2-hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl)amino]propanoyloxy]propyl]-trimethylazanium is a compound with the formula C16H32N2O10P+. It has an average molecular weight of 443.41 g/mol.</description> <cas nil="true"/> <pubchem-id>156962955</pubchem-id> <chemical-formula>C16H32N2O10P+</chemical-formula> <weight>443.41</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">2026-08-28T21:52:43Z</created-at> <updated-at type="dateTime">2026-08-28T21:52:43Z</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>CC(C)(COP(=O)(O)O)C(C(=O)NCCC(=O)OC(CC(=O)O)C[N+](C)(C)C)O</moldb-smiles> <moldb-formula>C16H32N2O10P+</moldb-formula> <moldb-inchi>InChI=1S/C16H31N2O10P/c1-16(2,10-27-29(24,25)26)14(22)15(23)17-7-6-13(21)28-11(8-12(19)20)9-18(3,4)5/h11,14,22H,6-10H2,1-5H3,(H3-,17,19,20,23,24,25,26)/p+1</moldb-inchi> <moldb-inchikey>QFGWSPGUGXALMJ-UHFFFAOYSA-O</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">443.1794572</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-2.2</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>CHEM300281</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>[3-carboxy-2-[3-[(2-hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl)amino]propanoyloxy]propyl]-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 nil="true"/> <superklass nil="true"/> <klass nil="true"/> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0255525</sync-id> <structure-inchikey>QFGWSPGUGXALMJ-UHFFFAOYSA-O</structure-inchikey> <structure-fingerprint>40000000400000000400800000002004000000000000000084000000100000000000000001000003000000000210000004800002000000000000000003000020000000000000000400000000000008000020001000000100000000000000000000000000010000000000000000080000000000000000000000000800000000000000000040000000000000000000040080000000000000000000000010000000002000000000000000000000002000000000000040080000000000000000000000000048000000000000100000000000000000000000080000400000000000000000001000020000021000000000000400000000000000000000000400020000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAdAAAAHAAAAIABBgBgAAAAAQMGACAAAAAE BgBgAAAAAQMGAGAAAAACAggAIAAAAAIPACAAAAAFCAAoAAAAAwIIAGAAAAAB AQgAYAAAAAEBBgBgAAAAAwEGACgAAAADBAgAKAAAAAMCBwBoAAAAAwIBBgBg AAAAAgIGAGAAAAACAgYAKAAAAAMECAAoAAAAAwIIACgAAAADAgYAYAAAAAMB BgBgAAAAAgIGACgAAAADBAgAKAAAAAMCCABoAAAAAwEBBgBgAAAAAgIHICIA AAABBAYAYAAAAAEDBgBgAAAAAQMGAGAAAAABAwgAYAAAAAEBCwABAAECAAED AAMEAAQFAAUGCAIFBwAFCAABCQAJCgAKCygCCgwgDA0ADQ4ADg8ADxAoAg8R IBESABITABMUABQVKAIUFiASFwAXGAAYGQAYGgAYGwAJHABCAAAAABcEAAAA AAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:13:25Z</structure-indexed-at> </compound>