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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:zofenopril
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Accession:CHEBI:78539 term browser browse the term
Definition:A proline derivative that is 4-(phenylsulfanyl)-L-proline in which the amine proton is replaced by a (2S)-3-(benzoylsulfanyl)-2-methylpropanoyl group. A prodrug for zofenoprilat.
Synonyms:exact_synonym: (4S)-1-[(2S)-3-(benzoylsulfanyl)-2-methylpropanoyl]-4-(phenylsulfanyl)-L-proline
 related_synonym: Formula=C22H23NO4S2;   InChI=1S/C22H23NO4S2/c1-15(14-28-22(27)16-8-4-2-5-9-16)20(24)23-13-18(12-19(23)21(25)26)29-17-10-6-3-7-11-17/h2-11,15,18-19H,12-14H2,1H3,(H,25,26)/t15-,18+,19+/m1/s1;   InChIKey=IAIDUHCBNLFXEF-MNEFBYGVSA-N;   SMILES=C[C@H](CSC(=O)c1ccccc1)C(=O)N1C[C@H](C[C@H]1C(O)=O)Sc1ccccc1;   zofenoprilum
 xref: CAS:81872-10-8;   Drug_Central:2866;   KEGG:D08688;   PMID:21377823;   PMID:21394524;   PMID:21888941;   PMID:22090052;   PMID:22107891;   PMID:22162922;   PMID:22455094;   PMID:22707187;   PMID:23030285;   PMID:23096377;   PMID:23552127;   PMID:23582628;   PMID:23882152;   PMID:24211724;   PMID:24415271;   PMID:24501330;   PMID:24583202;   PMID:24935917;   Reaxys:6443047;   Wikipedia:Zofenopril
 cyclic_relationship: is_conjugate_acid_of CHEBI:82601


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Term Annotations click to browse term
  CHEBI ontology 5052
    role 5044
      application 863
        pro-agent 40
          prodrug 23
            zofenopril 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
                    main group molecular entity 5012
                      s-block molecular entity 4970
                        hydrogen molecular entity 4964
                          hydrides 4544
                            inorganic hydride 403
                              pnictogen hydride 399
                                nitrogen hydride 399
                                  azane 391
                                    ammonia 391
                                      organic amino compound 284
                                        amino acid 183
                                          alpha-amino acid 149
                                            L-alpha-amino acid 151
                                              glutamine family amino acid 33
                                                L-proline 0
                                                  L-proline derivative 0
                                                    zofenopril 0
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