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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:captafol
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Accession:CHEBI:81938 term browser browse the term
Definition:A dicarboximide that captan in which the trichloromethyl group is replaced by a 1,1,2,2-tetrachloroethyl group. A broad-spectrum fungicide used to control diseases in fruit and potatoes, it is no longer approved for use in the European Community.
Synonyms:related_synonym: (tetrachloroethylthio)tetrahydrophthalimide;   1,2,3,6-tetrahydro-N-(1,1,2,2-tetrachloroethylthio)phthalimide;   2-[(1,1,2,2-tetrachloroethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione;   3a,4,7,7a-tetrahydro-2-[(1,1,2,2-tetrachloroethyl)thio]-1H-isoindole-1,3(2H)-dione;   3a,4,7,7a-tetrahydro-N-(1,1,2,2-tetrachloroethanesulphenyl)phthalimide;   Captaspor;   Difolatan;   Difosan;   Folcid;   Haipen;   Kenofol;   Merpafol;   N-(1,1,2,2-tetrachloroethylthio)-Delta(4)-tetrahydrophthalimide;   N-1,1,2,2-tetrachloroethylmercapto-4-cyclohexene-1,2-carboximide;   N-[(1,1,2,2-tetrachloroethyl)sulfenyl]-4-cyclohexene-1,2-dicarboximide;   Sanspor;   Terrazol
 xref: CAS:2425-06-1;   HMDB:HMDB0031669
 xref_mesh: MESH:C001614
 xref: PPDB:113;   Patent:BE633205;   Pesticides:captafol;   Reaxys:1543712;   Reaxys:234872;   kegg.compound:C18754;   pubmed:159800;   pubmed:1842583;   pubmed:21822319;   pubmed:8426061;   wikipedia.en:Captafol
 chemrof_formula: C10H9Cl4NO2S
 chemrof_inchi: InChI=1S/C10H9Cl4NO2S/c11-9(12)10(13,14)18-15-7(16)5-3-1-2-4-6(5)8(15)17/h1-2,5-6,9H,3-4H2
 chemrof_inchikey: JHRWWRDRBPCWTF-UHFFFAOYSA-N
 chemrof_smiles: O=C1C2CC=CCC2C(=O)N1SC(Cl)(Cl)C(Cl)Cl


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captafol term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Dio1 iodothyronine deiodinase 1 decreases activity ISO captafol results in decreased activity of DIO1 protein CTD PMID:29228274 PMID:30561685 NCBI chr 5:127,303,089...127,319,784
Ensembl chr 5:127,303,083...127,319,771 		JBrowse link
G Dio2 iodothyronine deiodinase 2 decreases activity ISO captafol results in decreased activity of DIO2 protein CTD PMID:30561685 NCBI chr 6:115,396,308...115,410,594
Ensembl chr 6:115,396,308...115,410,594 		JBrowse link
G Dio3 iodothyronine deiodinase 3 decreases activity ISO captafol results in decreased activity of DIO3 protein CTD PMID:30561685 NCBI chr 6:135,107,072...135,108,933
Ensembl chr 6:135,107,074...135,107,985 		JBrowse link
G Gstp1 glutathione S-transferase pi 1 multiple interactions
decreases activity 		ISO hexylglutathione inhibits the reaction [captafol results in decreased activity of GSTP1 protein] CTD PMID:8678907 NCBI chr 1:210,767,237...210,770,242
Ensembl chr 1:210,767,237...210,769,705 		JBrowse link
G Pcna proliferating cell nuclear antigen increases expression
multiple interactions 		EXP captafol results in increased expression of PCNA protein
Cysteine inhibits the reaction [captafol results in increased expression of PCNA protein] 		CTD PMID:9022123 NCBI chr 3:139,951,948...139,955,820
Ensembl chr 3:139,951,941...139,955,901 		JBrowse link
G Tff1 trefoil factor 1 decreases expression ISO captafol results in decreased expression of TFF1 mRNA CTD PMID:33352482 NCBI chr20:9,237,095...9,240,956
Ensembl chr20:9,237,095...9,240,956 		JBrowse link
G Top1 DNA topoisomerase I decreases activity ISO captafol results in decreased activity of TOP1 protein CTD PMID:12113771 NCBI chr 3:169,713,195...169,796,330
Ensembl chr 3:169,713,130...169,796,327 		JBrowse link
G Top2a DNA topoisomerase II alpha decreases activity ISO captafol results in decreased activity of TOP2A protein CTD PMID:12113771 NCBI chr10:84,441,954...84,473,093
Ensembl chr10:84,441,954...84,473,366 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 20874
    role 20844
      application 20572
        pesticide 18454
          antifungal agrochemical 11980
            captafol 8
Path 2
Term Annotations click to browse term
  CHEBI ontology 20874
    subatomic particle 20883
      composite particle 20883
        hadron 20872
          baryon 20883
            nucleon 20872
              atomic nucleus 20883
                atom 20872
                  main group element atom 20796
                    p-block element atom 20796
                      carbon group element atom 20712
                        carbon atom 20706
                          organic molecular entity 20706
                            organic molecule 20499
                              organic cyclic compound 20390
                                organic heterocyclic compound 19381
                                  organic heteropolycyclic compound 18616
                                    organic heterobicyclic compound 17442
                                      benzopyrrole 6369
                                        isoindoles 968
                                          captafol 8
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