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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:Purpurogenolide C
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Accession:CHEBI:227718 term browser browse the term
Synonyms:exact_synonym: methyl (1R,2S,14R,17R,19S,21R)-2,6,6,14,19-pentamethyl-11-methylidene-8,15,20-trioxo-7,16,18-trioxapentacyclo[12.6.1.02,12.05,10.017,21]henicosa-4,9-diene-1-carboxylate
 related_synonym: Formula=C26H30O8;   InChI=1S/C26H30O8/c1-12-14-10-17(27)34-23(3,4)15(14)8-9-25(6)16(12)11-24(5)18-20(33-21(24)29)32-13(2)19(28)26(18,25)22(30)31-7/h8,10,13,16,18,20H,1,9,11H2,2-7H3/t13-,16?,18+,20+,24+,25-,26+/m0/s1;   InChIKey=CELLGHOJUHAKBM-KWVDQYNKSA-N;   SMILES=O=C1OC(C2=CC[C@]3(C(C(C2=C1)=C)C[C@]4(C(=O)O[C@@H]5[C@H]4[C@@]3(C(=O)[C@@H](O5)C)C(=O)OC)C)C)(C)C
 xref: Chemspider:78438896


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 0
    chemical entity 0
      atom 0
        nonmetal atom 0
          oxygen atom 0
            oxygen molecular entity 0
              organooxygen compound 0
                oxacycle 0
                  furopyran 0
                    Purpurogenolide C 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic molecule 0
                              organic cyclic compound 0
                                organic heterocyclic compound 0
                                  organic heteropolycyclic compound 0
                                    organic heterobicyclic compound 0
                                      furopyran 0
                                        Purpurogenolide C 0
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