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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:bumadizone
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Accession:CHEBI:76119 term browser browse the term
Definition:A carbohydrazide obtained by formal condensation of one of the carboxy groups from butylmalonic acid with the hydrazino group of 1,2-diphenylhydrazine. Used (as its calcium semihydrate) for treatment of rheumatoid arthritis.
Synonyms:exact_synonym: 2-[(1,2-diphenylhydrazino)carbonyl]hexanoic acid
 related_synonym: Bumadizon;   Butylmalonic acid mono(1,2-diphenylhydrazide);   Formula=C19H22N2O3;   InChI=1S/C19H22N2O3/c1-2-3-14-17(19(23)24)18(22)21(16-12-8-5-9-13-16)20-15-10-6-4-7-11-15/h4-13,17,20H,2-3,14H2,1H3,(H,23,24);   InChIKey=FLWFHHFTIRLFPV-UHFFFAOYSA-N;   SMILES=CCCCC(C(O)=O)C(=O)N(Nc1ccccc1)c1ccccc1;   bumadizona;   bumadizonum;   bumazidone;   n-Butylmalonic acid N,N'-diphenylhydrazide
 xref: CAS:3583-64-0;   Drug_Central:426;   KEGG:D07264;   PMID:22222555;   PMID:2751413;   PMID:331502;   PMID:6894379;   PMID:6894380;   Patent:US2005249806;   Patent:WO2006124753;   Reaxys:696638;   Wikipedia:Bumadizone
 cyclic_relationship: is_conjugate_acid_of CHEBI:76124


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Path 1
Term Annotations click to browse term
  CHEBI ontology 5066
    role 5030
      application 869
        anti-inflammatory agent 71
          anti-inflammatory drug 50
            non-steroidal anti-inflammatory drug 18
              bumadizone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5066
    subatomic particle 5057
      composite particle 5057
        hadron 5057
          baryon 5057
            nucleon 5057
              atomic nucleus 5057
                atom 5057
                  main group element atom 5026
                    p-block element atom 5023
                      carbon group element atom 4940
                        carbon atom 4939
                          organic molecular entity 4939
                            heteroorganic entity 4779
                              organochalcogen compound 4741
                                organooxygen compound 4703
                                  carbonyl compound 4654
                                    dicarboxylic acids and O-substituted derivatives 66
                                      dicarboxylic acid 66
                                        alpha,omega-dicarboxylic acid 22
                                          malonic acid 0
                                            bumadizone 0
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