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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:metronidazole hydrochloride
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Accession:CHEBI:50687 term browser browse the term
Definition:A hydrochloride salt resulting from the mixture of equimolar amounts of metronidazole and hydrogen chloride.
Synonyms:exact_synonym: 2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethanol hydrochloride
 related_synonym: 2-Methyl-5-nitroimidazole-1-ethanol hydrochloride;   2-Methyl-5-nitroimidazole-1-ethanol monohydrochloride;   Flagyl;   Formula=C6H10ClN3O3;   InChI=1S/C6H9N3O3.ClH/c1-5-7-4-6(9(11)12)8(5)2-3-10;/h4,10H,2-3H2,1H3;1H;   InChIKey=FPTPAIQTXYFGJC-UHFFFAOYSA-N;   Metronidazole HCl;   SMILES=Cl.Cc1ncc(n1CCO)[N+]([O-])=O
 xref: Beilstein:11001903;   CAS:69198-10-3;   DrugBank:DB00916;   KEGG:D05016;   PMID:4003408;   PMID:4083286;   PMID:7064251;   PMID:7464682;   Reaxys:11001903


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 5052
    role 5044
      biological role 5016
        antimicrobial agent 256
          metronidazole hydrochloride 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5052
    subatomic particle 5043
      composite particle 5043
        hadron 5071
          baryon 5043
            nucleon 5043
              atomic nucleus 5043
                atom 5043
                  main group element atom 5013
                    p-block element atom 5010
                      halogen 317
                        chlorine atom 261
                          chlorine molecular entity 266
                            elemental chlorine 27
                              monoatomic chlorine 13
                                chloride 13
                                  chloride salt 13
                                    organic chloride salt 5
                                      hydrochloride 5
                                        metronidazole hydrochloride 0
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