20222 <common-name>sn-Glycerol 3-phosphate bis(cyclohexylammonium)</common-name> <description nil="true"/> <cas>29849-82-9</cas> <pubchem-id nil="true"/> <chemical-formula>C15H35N2O6P</chemical-formula> <weight nil="true"/> <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">2016-05-22T05:50:13Z</created-at> <updated-at type="dateTime">2026-04-05T14:29:54Z</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>NC1CCCCC1.NC1CCCCC1.[H][C@@](O)(CO)COP(O)(O)=O</moldb-smiles> <moldb-formula>C15H35N2O6P</moldb-formula> <moldb-inchi>InChI=1S/2C6H13N.C3H9O6P/c2*7-6-4-2-1-3-5-6;4-1-3(5)2-9-10(6,7)8/h2*6H,1-5,7H2;3-5H,1-2H2,(H2,6,7,8)/t;;3-/m..1/s1</moldb-inchi> <moldb-inchikey>FWIDSLORBURWJY-CFMHHUGTSA-N</moldb-inchikey> <moldb-average-mass type="decimal">370.427</moldb-average-mass> <moldb-mono-mass type="decimal">370.223273853</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>CHEM019117</chemdb-id> <dsstox-id>DTXSID9046603</dsstox-id> <toxcast-id>46603</toxcast-id> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00074165</susdat-id> <iupac nil="true"/> <moldb-polar-surface-area>107.22000000000001</moldb-polar-surface-area> <moldb-refractivity>31.389</moldb-refractivity> <moldb-polarizability>13.453796443525878</moldb-polarizability> <moldb-rotatable-bond-count>4</moldb-rotatable-bond-count> <moldb-acceptor-count>5</moldb-acceptor-count> <moldb-donor-count>4</moldb-donor-count> <moldb-pka-strongest-acidic>1.5077547010974532</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic>-2.968964717967575</moldb-pka-strongest-basic> <moldb-physiological-charge>-2</moldb-physiological-charge> <moldb-number-of-rings>2</moldb-number-of-rings> <moldb-alogps-logp>-1.84</moldb-alogps-logp> <moldb-alogps-logs>-0.75</moldb-alogps-logs> <moldb-alogps-solubility>3.06e+01 g/l</moldb-alogps-solubility> </compound>