363792 <common-name>2-[1,3-dihydroxypropan-2-yloxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium</common-name> <description>2-[1,3-dihydroxypropan-2-yloxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium is a compound with the formula C8H21NO6P+. It has an average molecular weight of 258.23 g/mol.</description> <cas nil="true"/> <pubchem-id>91212825</pubchem-id> <chemical-formula>C8H21NO6P+</chemical-formula> <weight>258.23</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">2026-09-01T13:27:39Z</created-at> <updated-at type="dateTime">2026-09-01T13:27:39Z</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>C[N+](C)(C)CCOP(=O)(O)OC(CO)CO</moldb-smiles> <moldb-formula>C8H21NO6P+</moldb-formula> <moldb-inchi>InChI=1S/C8H20NO6P/c1-9(2,3)4-5-14-16(12,13)15-8(6-10)7-11/h8,10-11H,4-7H2,1-3H3/p+1</moldb-inchi> <moldb-inchikey>DQBGWLUPOYEQQT-UHFFFAOYSA-O</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">258.1106494</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-2.3</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>CHEM359685</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-[1,3-dihydroxypropan-2-yloxy(hydroxy)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>Organic nitrogen compounds</superklass> <klass>Organonitrogen compounds</klass> <subklass>Quaternary ammonium salts</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0313815</sync-id> <structure-inchikey>DQBGWLUPOYEQQT-UHFFFAOYSA-O</structure-inchikey> <structure-fingerprint>40040000000000000000800000000004000000000000000080000002000000000000000000000005000000000000000000000002000000000000000022000000000000000000000010000000000008000020000000000100000000000000000000000000010000000000000000000000800040000000000000000800000000000020000040000000000000000000000000000000000080000000000000000000000000000000000000008000000000000000000000000000000000001000000000000000000080000000000000000000000000000000080000000000000000400000000000020000000000000000000000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>500000200102020080000000010820000000040000052000002000408220004c4402005000800000000001000080000006200001008c10010000443100a04000c4110400000007000080100000620800000004804000083240000422400001200c2000020048020040000000d4b00000208080100101a0041118000002100002404000080c4000080800020008080008111400124400140200000b0000000080024300000000400000000840012c211002c000008801080010000010004002008c1000a4048000021080000020010280000000000200400001003000080000008000081000000000000000010010200400100010c04080040000010050000002</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAADwAAAIABBgBgAAAAAQMHICIAAAAB BAYAYAAAAAEDBgBgAAAAAQMGAGAAAAACAgYAYAAAAAICCAAgAAAAAg8AIAAA AAUIACgAAAADAggAYAAAAAEBCAAgAAAAAgYAYAAAAAMBBgBgAAAAAgIIAGAA AAABAQYAYAAAAAICCABgAAAAAQELAAEAAQIAAQMAAQQABAUABQYABgcABwgI AgcJAAcKAAoLAAsMAAwNAAsOAA4PAEIAAAAAFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T06:00:19Z</structure-indexed-at> </compound>