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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:DDE
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Accession:CHEBI:16598 term browser browse the term
Definition:A chlorophenylethylene that is ethylene substituted by two 4-chlorophenyl groups at position 1 and two chlorine atoms at position 2.
Synonyms:exact_synonym: 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene
 related_synonym: 1,1'-(2,2-dichloroethene-1,1-diyl)bis(4-chlorobenzene);   1,1-bis-(4-chlorophenyl)-2,2-dichloroethene;   1,1-dichloro-2,2-bis(4-chlorophenyl)ethylene;   2,2'-bis(4-chlorophenyl)-1,1-dichloroethylene;   4,4'-DDE;   Formula=C14H8Cl4;   InChI=1S/C14H8Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8H;   InChIKey=UCNVFOCBFJOQAL-UHFFFAOYSA-N;   SMILES=ClC(Cl)=C(C1=CC=C(Cl)C=C1)C1=CC=C(Cl)C=C1;   p,p'-(Dichlorodiphenyl)-2,2-dichloroethylene;   p,p'-DDE
 alt_id: CHEBI:11130;   CHEBI:18851;   CHEBI:195494;   CHEBI:474
 xref: CAS:72-55-9;   FooDB:FDB097419;   HMDB:HMDB0304759;   KEGG:C04596
 xref_mesh: MESH:D003633
 xref: MetaCyc:DICHLOROBIS-CPD;   PDBeChem:6WS;   PMCID:PMC7208238;   PMID:11513126;   PMID:15070871;   PMID:15710169;   PMID:20368122;   PMID:22142728;   PMID:23415487;   PMID:24328540;   PMID:28042045;   PMID:31792309;   PMID:32393266;   PMID:33287856;   PMID:33756427;   PMID:35623197;   PMID:37236336;   Reaxys:1913355;   UM-BBD_compID:c0406;   Wikipedia:Dichlorodiphenyldichloroethylene


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      CHEBI ontology 19898
        role 19868
          chemical role 19498
            environmental contaminant 18883
              persistent organic pollutant 16792
                DDE 2299
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      CHEBI ontology 19898
        subatomic particle 19896
          composite particle 19896
            hadron 19896
              baryon 19896
                nucleon 19896
                  atomic nucleus 19896
                    atom 19896
                      main group element atom 19835
                        p-block element atom 19835
                          carbon group element atom 19774
                            carbon atom 19771
                              organic molecular entity 19771
                                organic molecule 19724
                                  organic cyclic compound 19515
                                    carbocyclic compound 18601
                                      benzenoid aromatic compound 18028
                                        benzenes 17893
                                          chlorobenzenes 15061
                                            monochlorobenzenes 12159
                                              DDE 2299
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