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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:4,5-dichloro-2-n-octyl-3(2H)-isothiazolone
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Accession:CHEBI:83518 term browser browse the term
Definition:A 1,2-thiazole that is 1,2-thiazol-3(2H)-one substituted by chloro groups at positions 4 and 5 and an octyl group at position 2. It is used as a fungicide.
Synonyms:exact_synonym: 4,5-dichloro-2-octyl-1,2-thiazol-3(2H)-one
 related_synonym: DCOIT;   Formula=C11H17Cl2NOS;   InChI=1S/C11H17Cl2NOS/c1-2-3-4-5-6-7-8-14-11(15)9(12)10(13)16-14/h2-8H2,1H3;   InChIKey=PORQOHRXAJJKGK-UHFFFAOYSA-N;   Kathon 930;   SMILES=CCCCCCCCn1sc(Cl)c(Cl)c1=O;   dichlorooctylisothiazolinone
 xref: CAS:64359-81-5
 xref_mesh: MESH:C080469
 xref: PMID:24850171;   Patent:NZ524752;   Patent:US2010256204;   Reaxys:1110842



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4,5-dichloro-2-n-octyl-3(2H)-isothiazolone term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Dio1 iodothyronine deiodinase 1 decreases activity ISO Kathon 930 results in decreased activity of DIO1 protein CTD PMID:30561685 NCBI chr 5:122,074,285...122,090,983
Ensembl chr 5:122,074,279...122,090,970
JBrowse link
G Dio2 iodothyronine deiodinase 2 decreases activity ISO Kathon 930 results in decreased activity of DIO2 protein CTD PMID:30561685 NCBI chr 6:109,665,523...109,679,809
Ensembl chr 6:109,665,523...109,679,809
JBrowse link
G Dio3 iodothyronine deiodinase 3 decreases activity ISO Kathon 930 results in decreased activity of DIO3 protein CTD PMID:30561685 NCBI chr 6:129,285,747...129,287,608
Ensembl chr 6:129,285,749...129,286,660
JBrowse link
G Iyd iodotyrosine deiodinase multiple interactions ISO Kathon 930 inhibits the reaction [IYD protein results in increased metabolism of Monoiodotyrosine] CTD PMID:33352258 NCBI chr 1:40,003,999...40,019,323
Ensembl chr 1:40,004,041...40,019,319
JBrowse link

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Term Annotations click to browse term
  CHEBI ontology 19795
    role 19746
      biological role 19746
        xenobiotic 18434
          4,5-dichloro-2-n-octyl-3(2H)-isothiazolone 4
Path 2
Term Annotations click to browse term
  CHEBI ontology 19795
    subatomic particle 19794
      composite particle 19794
        hadron 19794
          baryon 19794
            nucleon 19794
              atomic nucleus 19794
                atom 19794
                  main group element atom 19693
                    p-block element atom 19693
                      carbon group element atom 19614
                        carbon atom 19604
                          organic molecular entity 19604
                            organic molecule 19545
                              organic cyclic compound 19339
                                organic heterocyclic compound 18579
                                  heteroarene 16539
                                    monocyclic heteroarene 13505
                                      azole 12710
                                        thiazoles 1723
                                          1,2-thiazoles 662
                                            4,5-dichloro-2-n-octyl-3(2H)-isothiazolone 4
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