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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:1-(4-chlorophenoxy)-3-\{[2-(4-ethoxyphenyl)-3,3,3-trifluoropropoxy]methyl\}benzene
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Accession:CHEBI:149764 term browser browse the term
Definition:An aromatic ether that is [3-(4-chlorophenoxy)phenyl]methanol in which the hydroxy group is replaced by a 2-(4-ethoxyphenyl)-3,3,3-trifluoropropoxy group.
Synonyms:related_synonym: Formula=C24H22ClF3O3;   InChI=1S/C24H22ClF3O3/c1-2-30-20-10-6-18(7-11-20)23(24(26,27)28)16-29-15-17-4-3-5-22(14-17)31-21-12-8-19(25)9-13-21/h3-14,23H,2,15-16H2,1H3;   InChIKey=RURQAJURNPMSSK-UHFFFAOYSA-N;   SMILES=ClC1=CC=C(OC=2C=C(COCC(C3=CC=C(OCC)C=C3)C(F)(F)F)C=CC2)C=C1



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Path 1
Term Annotations click to browse term
  CHEBI ontology 20057
    chemical entity 20068
      molecular entity 20056
        polyatomic entity 19987
          heteroatomic molecular entity 19923
            halide 18490
              organohalogen compound 18336
                organofluorine compound 12472
                  1-(4-chlorophenoxy)-3-\{[2-(4-ethoxyphenyl)-3,3,3-trifluoropropoxy]methyl\}benzene 0
                    (R)-flufenprox + 0
                    (S)-flufenprox + 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 20057
    subatomic particle 20056
      composite particle 20068
        hadron 20056
          baryon 20056
            nucleon 20056
              atomic nucleus 20056
                atom 20056
                  main group element atom 19971
                    p-block element atom 19971
                      carbon group element atom 19889
                        carbon atom 19894
                          organic molecular entity 19882
                            organic molecule 19830
                              organic cyclic compound 19603
                                carbocyclic compound 18553
                                  benzenoid aromatic compound 17803
                                    benzenes 17609
                                      chlorobenzenes 13881
                                        monochlorobenzenes 9913
                                          1-(4-chlorophenoxy)-3-\{[2-(4-ethoxyphenyl)-3,3,3-trifluoropropoxy]methyl\}benzene 0
                                            (R)-flufenprox + 0
                                            (S)-flufenprox + 0
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