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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:Pleuromutilin
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Accession:CHEBI:8269 term browser browse the term
Definition:A carbotricyclic compound that has formula C22H34O5.
Synonyms:xref: CAS:125-65-5;   KNApSAcK:C00003473;   kegg.compound:C09169
 chemrof_formula: C22H34O5
 chemrof_inchi: InChI=1S/C22H34O5/c1-6-20(4)11-16(27-17(25)12-23)21(5)13(2)7-9-22(14(3)19(20)26)10-8-15(24)18(21)22/h6,13-14,16,18-19,23,26H,1,7-12H2,2-5H3/t13?,14-,16+,18-,19-,20+,21-,22-/m0/s1
 chemrof_inchikey: ZRZNJUXESFHSIO-ZXVYJXQESA-N
 chemrof_smiles: [H][C@@]12C(=O)CC[C@]13CCC(C)[C@@]2(C)[C@H](OC(=O)CO)C[C@@](C)(C=C)[C@@H](O)[C@@H]3C



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Path 1
Term Annotations click to browse term
  CHEBI ontology 20874
    chemical entity 20872
      group 20774
        inorganic group 20110
          oxo group 18827
            organic oxo compound 18827
              carbonyl compound 18827
                carboxylic ester 17347
                  Pleuromutilin 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
                      carbon group element atom 20712
                        carbon atom 20706
                          organic molecular entity 20706
                            heteroorganic entity 20201
                              organochalcogen compound 19822
                                organooxygen compound 19713
                                  carbonyl compound 18827
                                    ketone 17484
                                      cyclic ketone 16169
                                        Pleuromutilin 0
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