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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 EXP Kathon 930 results in decreased activity of DIO1 protein CTD PMID:30561685 NCBI chr 1:53,894,187...53,911,086
Ensembl chr 1:53,891,239...53,911,086
JBrowse link
G DIO2 iodothyronine deiodinase 2 decreases activity EXP Kathon 930 results in decreased activity of DIO2 protein CTD PMID:30561685 NCBI chr14:80,197,526...80,231,057
Ensembl chr14:80,197,526...80,387,757
JBrowse link
G DIO3 iodothyronine deiodinase 3 decreases activity EXP Kathon 930 results in decreased activity of DIO3 protein CTD PMID:30561685 NCBI chr14:101,561,495...101,563,452
Ensembl chr14:101,560,139...101,563,452
JBrowse link
G IYD iodotyrosine deiodinase multiple interactions EXP Kathon 930 inhibits the reaction [IYD protein results in increased metabolism of Monoiodotyrosine] CTD PMID:33352258 NCBI chr 6:150,369,012...150,405,969
Ensembl chr 6:150,368,892...150,405,969
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 26034
    role 25961
      biological role 25929
        xenobiotic 20368
          4,5-dichloro-2-n-octyl-3(2H)-isothiazolone 4
Path 2
Term Annotations click to browse term
  CHEBI ontology 26034
    subatomic particle 26009
      composite particle 26009
        hadron 26020
          baryon 26009
            nucleon 26009
              atomic nucleus 26009
                atom 26009
                  main group element atom 25834
                    p-block element atom 25834
                      carbon group element atom 25434
                        carbon atom 25403
                          organic molecular entity 25392
                            organic molecule 25222
                              organic cyclic compound 24274
                                organic heterocyclic compound 22328
                                  heteroarene 18772
                                    monocyclic heteroarene 16133
                                      azole 15691
                                        thiazoles 2093
                                          1,2-thiazoles 940
                                            4,5-dichloro-2-n-octyl-3(2H)-isothiazolone 4
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