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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:givinostat hydrochloride
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Accession:CHEBI:231333 term browser browse the term
Definition:The hydrochloride salt of givinostat.
Synonyms:related_synonym: ITF-2357 hydrochloride;   ITF2357 hydrochloride;   givinostat HCl;   givinostat monohydrochloride;   {6-[(diethylamino)methyl]naphthalen-2-yl}methyl [4-(hydroxycarbamoyl)phenyl]carbamate hydrochloride;   {6-[(diethylamino)methyl]naphthalen-2-yl}methyl [4-(hydroxycarbamoyl)phenyl]carbamate--hydrogen chloride
 xref: CAS:199657-29-9
 chemrof_formula: C24H27N3O4.HCl
 chemrof_smiles: CCN(CC)Cc1ccc2cc(COC(=O)Nc3ccc(C(=O)NO)cc3)ccc2c1.Cl
 chemrof_inchi: InChI=1S/C24H27N3O4.ClH/c1-3-27(4-2)15-17-5-7-21-14-18(6-8-20(21)13-17)16-31-24(29)25-22-11-9-19(10-12-22)23(28)26-30;/h5-14,30H,3-4,15-16H2,1-2H3,(H,25,29)(H,26,28);1H
 chemrof_inchikey: QKSGNWJOQMSBEP-UHFFFAOYSA-N


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Term Annotations click to browse term
  CHEBI ontology 20874
    role 20844
      application 20572
        anti-inflammatory agent 16713
          givinostat hydrochloride 0
            givinostat hydrochloride monohydrate 0
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
                      halogen 19174
                        chlorine atom 18936
                          chlorine molecular entity 18936
                            elemental chlorine 10248
                              monoatomic chlorine 10235
                                chloride 10235
                                  chloride salt 10235
                                    organic chloride salt 1119
                                      hydrochloride 749
                                        givinostat hydrochloride 0
                                          givinostat hydrochloride monohydrate 0
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