8693 <common-name>SUCROSE MONOPALMITATE</common-name> <description nil="true"/> <cas>26446-38-8</cas> <pubchem-id>21140494</pubchem-id> <chemical-formula>C28H52O12</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">2016-05-19T02:27:50Z</created-at> <updated-at type="dateTime">2026-04-03T10:12:20Z</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>[H][C@]1(CO)O[C@@](CO)(O[C@@]2([H])O[C@]([H])(CO)[C@@]([H])(O)[C@]([H])(O)[C@@]2([H])O)[C@@]([H])(OC(=O)CCCCCCCCCCCCCCC)[C@]1([H])O</moldb-smiles> <moldb-formula>C28H52O12</moldb-formula> <moldb-inchi>InChI=1S/C28H52O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(32)38-26-23(34)20(17-30)39-28(26,18-31)40-27-25(36)24(35)22(33)19(16-29)37-27/h19-20,22-27,29-31,33-36H,2-18H2,1H3/t19-,20-,22-,23-,24+,25-,26+,27-,28+/m1/s1</moldb-inchi> <moldb-inchikey>ODCGMAWJSFNWJQ-ZRVLSRDKSA-N</moldb-inchikey> <moldb-average-mass type="decimal">580.712</moldb-average-mass> <moldb-mono-mass type="decimal">580.345877114</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>20003730</chemspider-id> <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>CHEM007588</chemdb-id> <dsstox-id>DTXSID10192546</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00022142</susdat-id> <iupac nil="true"/> <moldb-polar-surface-area>195.59999999999994</moldb-polar-surface-area> <moldb-refractivity>142.3655</moldb-refractivity> <moldb-polarizability>64.4887995848741</moldb-polarizability> <moldb-rotatable-bond-count>21</moldb-rotatable-bond-count> <moldb-acceptor-count>11</moldb-acceptor-count> <moldb-donor-count>7</moldb-donor-count> <moldb-pka-strongest-acidic>12.112625804116593</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic>-2.9810849128024266</moldb-pka-strongest-basic> <moldb-physiological-charge>0</moldb-physiological-charge> <moldb-number-of-rings>2</moldb-number-of-rings> <moldb-alogps-logp>2.40</moldb-alogps-logp> <moldb-alogps-logs>-3.12</moldb-alogps-logs> <moldb-alogps-solubility>4.43e-01 g/l</moldb-alogps-solubility> </compound>