279892 <common-name>4-(3-hydroxy-2,4,6-triiodoanilino)-4-oxobutanoic acid</common-name> <description>4-(3-hydroxy-2,4,6-triiodoanilino)-4-oxobutanoic acid belongs to the anilides, a subclass of benzene and substituted derivatives within the organic compounds. It is classified as a benzenoid with the chemical formula C10H8I3NO4. With an average molecular weight of 586.89 g/mol, 4-(3-hydroxy-2,4,6-triiodoanilino)-4-oxobutanoic acid is a heavy molecule.</description> <cas>1217-69-2</cas> <pubchem-id>121063</pubchem-id> <chemical-formula>C10H8I3NO4</chemical-formula> <weight>586.89</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">2026-08-26T19:49:48Z</created-at> <updated-at type="dateTime">2026-08-26T19:49:48Z</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>C1=C(C(=C(C(=C1I)O)I)NC(=O)CCC(=O)O)I</moldb-smiles> <moldb-formula>C10H8I3NO4</moldb-formula> <moldb-inchi>InChI=1S/C10H8I3NO4/c11-4-3-5(12)10(18)8(13)9(4)14-6(15)1-2-7(16)17/h3,18H,1-2H2,(H,14,15)(H,16,17)</moldb-inchi> <moldb-inchikey>XRSMSKBZGDJGAX-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">586.7588</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.1</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>CHEM275785</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>4-(3-hydroxy-2,4,6-triiodoanilino)-4-oxobutanoic acid</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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Anilides</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0231938</sync-id> <structure-inchikey>XRSMSKBZGDJGAX-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000008080000000000000000000000000002000000000000000000000000000000000000000400004040000000000000000000000000000040000000000000000020000000000000000200400080000000000000000000000000000000100000000800000001000000000000000001000000000000000000000000000000000000000000000000000800000000000080000000000008000000100000000000000000000000a0000000000000000000000000000000000000000000008000000002000000800000000000000000000000010400000000000000000008000000000000040000000000400000000000000000000040000000000</structure-fingerprint> <structure-pattern-fingerprint>500000200902060088000040010a2050000004000105200000342040a200008c44020050128000440004410800800000042000ac808c32010200643000a04000c4110400020806000090102000628300000005805100103240000422000209000c2804060048820000000000d4340001200680100105e0047138020002310002004400184c54020808000200880c0008115c0012464014020004080000400080004300001010c00802000940057c211002c00000894108c010004210084002100000008404402012018000040401028004000000021050000d000204080001001010081000000000000000034112200000100010804200060008008050040406</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAASAAAAEgAAAIABBkBoAAAAAwMBBkAoAAAA AwQGQCgAAAADBAZAKAAAAAMEBkAoAAAAAwQGQCgAAAADBDUAIAAAAAEIAGgA AAADAQE1ACAAAAABBwBoAAAAAwIBBgAoAAAAAwQIACgAAAADAgYAYAAAAAIC BgBgAAAAAgIGACgAAAADBAgAKAAAAAMCCABoAAAAAwEBNQAgAAAAAQsAAWgM AQJoDAIDaAwDBGgMBAVoDAUGAAQHIAMIAAIJIAkKIAoLKAIKDAAMDQANDgAO DygCDhAgAREABQBoDEIBAAAABgAFBAMCARcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:55:06Z</structure-indexed-at> </compound>