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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:crisaborole
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Accession:CHEBI:134677 term browser browse the term
Definition:A member of the class of benzoxaboroles that is 5-hydroxy-1,3-dihydro-2,1-benzoxaborole in which the phenolic hydrogen has been replaced by a 4-cyanophenyl group. A phosphodiesterase 4 inhibitor that is used for treatment of mild to moderate atopic dermatitis in children and adults.
Synonyms:exact_synonym: 4-[(1-hydroxy-1,3-dihydro-2,1-benzoxaborol-5-yl)oxy]benzonitrile
 related_synonym: AN 2728;   AN2728;   Crisaborole topical ointment 2%;   Eucrisa;   Formula=C14H10BNO3;   InChI=1S/C14H10BNO3/c16-8-10-1-3-12(4-2-10)19-13-5-6-14-11(7-13)9-18-15(14)17/h1-7,17H,9H2;   InChIKey=USZAGAREISWJDP-UHFFFAOYSA-N;   SMILES=C1=C(C=C2C(=C1)B(OC2)O)OC3=CC=C(C=C3)C#N
 xref: CAS:906673-24-3;   KEGG:D10873;   PMID:19303290;   PMID:19876791;   PMID:20094643;   PMID:20383346;   PMID:23625818;   PMID:24852768;   PMID:26461821;   PMID:26659931;   PMID:26777394;   PMID:26885784;   PMID:27050693;   PMID:27193740;   PMID:27283509;   PMID:27335049;   PMID:27353073;   PMID:27417017;   PMID:27525671;   PMID:27928191;   PMID:28163553;   Reaxys:11622826


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  CHEBI ontology 0
    chemical entity 0
      group 0
        pseudohalo group 0
          cyano group 0
            nitrile 0
              crisaborole 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic molecule 0
                              organic cyclic compound 0
                                organic heterocyclic compound 0
                                  organic heteropolycyclic compound 0
                                    organic heterobicyclic compound 0
                                      benzoxaborole 0
                                        crisaborole 0
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