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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:octhilinone
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Accession:CHEBI:81936 term browser browse the term
Definition:A member of the class of 1,2-thiazole that is 1,2-thiazol-3-one substituted on the nitrogen (position 2) by an octyl group. A fungicide and antibacterial agent, it is used for treatment of canker and other fungal and bacterial diseases in fruit trees. It is no longer approved for use within the European Union.
Synonyms:exact_synonym: 2-octyl-1,2-thiazol-3(2H)-one
 related_synonym: 2-Octyl-3(2H)-isothiazolone;   2-Octyl-3-isothiazolinone;   2-Octyl-3-isothiazolone;   2-Octyl-3-isothioazolone;   2-Octyl-4-isothiazolin-3-one;   2-n-Octyl-4-isothiazolin-3-one;   2-octyl-2H-isothiazol-3-one;   Formula=C11H19NOS;   InChI=1S/C11H19NOS/c1-2-3-4-5-6-7-9-12-11(13)8-10-14-12/h8,10H,2-7,9H2,1H3;   InChIKey=JPMIIZHYYWMHDT-UHFFFAOYSA-N;   Octyl-3(2H)-isothiazolone;   Octyl-4-isothiazol-3-one;   SMILES=CCCCCCCCn1sccc1=O
 xref: AGR:IND87046906;   CAS:26530-20-1;   KEGG:C18752
 xref_mesh: MESH:C035331
 xref: PMID:20960358;   PMID:23182288;   PPDB:489;   Pesticides:octhilinone;   Reaxys:1211137



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octhilinone term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Casp3 caspase 3 increases activity ISO 2-n-octyl-4-isothiazolin-3-one results in increased activity of CASP3 protein CTD PMID:33806369 NCBI chr16:45,662,910...45,681,171
Ensembl chr16:45,662,910...45,684,648
JBrowse link
G Cldn5 claudin 5 decreases expression ISO 2-n-octyl-4-isothiazolin-3-one results in decreased expression of CLDN5 protein CTD PMID:33806369 NCBI chr11:82,212,822...82,214,248
Ensembl chr11:82,211,475...82,214,992
JBrowse link
G Dio1 iodothyronine deiodinase 1 decreases activity ISO 2-n-octyl-4-isothiazolin-3-one 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 2-n-octyl-4-isothiazolin-3-one 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 2-n-octyl-4-isothiazolin-3-one 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 Tjp1 tight junction protein 1 decreases expression ISO 2-n-octyl-4-isothiazolin-3-one results in decreased expression of TJP1 protein CTD PMID:33806369 NCBI chr 1:118,849,838...119,094,492
Ensembl chr 1:118,849,838...119,094,432
JBrowse link

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Term Annotations click to browse term
  CHEBI ontology 20059
    role 20009
      biological role 20008
        xenobiotic 18633
          octhilinone 6
Path 2
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  CHEBI ontology 20059
    subatomic particle 20056
      composite particle 20056
        hadron 20056
          baryon 20056
            nucleon 20056
              atomic nucleus 20056
                atom 20056
                  main group element atom 19956
                    p-block element atom 19956
                      carbon group element atom 19882
                        carbon atom 19873
                          organic molecular entity 19873
                            organic molecule 19819
                              organic cyclic compound 19581
                                organic heterocyclic compound 18804
                                  heteroarene 16601
                                    monocyclic heteroarene 13600
                                      azole 12823
                                        thiazoles 1736
                                          1,2-thiazoles 676
                                            octhilinone 6
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