17837 <common-name>Iocetamic acid</common-name> <description nil="true"/> <cas>16034-77-8</cas> <pubchem-id>27648</pubchem-id> <chemical-formula>C12H13I3N2O3</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">2016-05-22T03:41:48Z</created-at> <updated-at type="dateTime">2026-03-31T17:22:13Z</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(CN(C(C)=O)C1=C(I)C=C(I)C(N)=C1I)C(O)=O</moldb-smiles> <moldb-formula>C12H13I3N2O3</moldb-formula> <moldb-inchi>InChI=1S/C12H13I3N2O3/c1-5(12(19)20)4-17(6(2)18)11-8(14)3-7(13)10(16)9(11)15/h3,5H,4,16H2,1-2H3,(H,19,20)</moldb-inchi> <moldb-inchikey>GSVQIUGOUKJHRC-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">613.96</moldb-average-mass> <moldb-mono-mass type="decimal">613.80603</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>25724</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>CHEM016732</chemdb-id> <dsstox-id>DTXSID2023149</dsstox-id> <toxcast-id>23149</toxcast-id> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00008882</susdat-id> <iupac>3-[N-(3-amino-2,4,6-triiodophenyl)acetamido]-2-methylpropanoic acid</iupac> </compound>