44459 <common-name>Valifenalate</common-name> <description nil="true"/> <cas>283159-90-0</cas> <pubchem-id>15982923</pubchem-id> <chemical-formula>C19H27ClN2O5</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">2016-06-03T10:50:43Z</created-at> <updated-at type="dateTime">2026-03-26T21:35:28Z</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>COC(=O)CC(N=C(O)C(N=C(O)OC(C)C)C(C)C)C1=CC=C(Cl)C=C1</moldb-smiles> <moldb-formula>C19H27ClN2O5</moldb-formula> <moldb-inchi>InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)</moldb-inchi> <moldb-inchikey>DBXFMOWZRXXBRN-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">398.88</moldb-average-mass> <moldb-mono-mass type="decimal">398.1608497</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>13114307</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>CHEM043354</chemdb-id> <dsstox-id>DTXSID6058051</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin>University of Hertfordshire (2013) The Pesticide Properties DataBase (PPDB) developed by the Agriculture & Environment Research Unit (AERU), University of Hertfordshire, 2006-2013</stoff-ident-origin> <stoff-ident-id>SI00002247</stoff-ident-id> <susdat-id>NS00003769</susdat-id> <iupac>N-[1-(4-chlorophenyl)-3-methoxy-3-oxopropyl]-2-{[hydroxy(propan-2-yloxy)methylidene]amino}-3-methylbutanimidic acid</iupac> </compound>