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ONTOLOGY REPORT - ANNOTATIONS


Term:berkeleyone A
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Accession:CHEBI:69024 term browser browse the term
Definition:A meroterpenoid found in Penicillium rubrum and has been shown to exhibit inhibitory activity against caspase-1.
Synonyms:exact_synonym: rel-methyl (3R,4aS,6aS,7R,9S,11R,12aS,12bS)-3,9-dihydroxy-4,4,6a,9,11,12b-hexamethyl-13-methylidene-8,10-dioxotetradecahydro-7,11-methanocycloocta[a]naphthalene-7(2H)-carboxylate
 related_synonym: Formula=C26H38O6;   InChI=1S/C26H38O6/c1-14-23(5)13-16-22(4)11-10-17(27)21(2,3)15(22)9-12-24(16,6)26(14,20(30)32-8)19(29)25(7,31)18(23)28/h15-17,27,31H,1,9-13H2,2-8H3/t15-,16+,17-,22-,23-,24+,25+,26+/m1/s1;   InChIKey=NNHHTFDBMMPBSL-JFPRQHOTSA-N;   SMILES=COC(=O)[C@@]12C(=C)[C@@](C)(C[C@H]3[C@]4(C)CC[C@@H](O)C(C)(C)[C@H]4CC[C@]13C)C(=O)[C@](C)(O)C2=O
 xref: PMID:21916432;   Reaxys:23869569


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Path 1
Term Annotations click to browse term
  CHEBI ontology 24141
    role 24034
      application 23445
        fuel 10803
          methanol 3134
            methyl ester 3121
              berkeleyone A 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 24141
    subatomic particle 24095
      composite particle 24095
        hadron 24095
          baryon 24095
            nucleon 24095
              atomic nucleus 24095
                atom 24095
                  main group element atom 23924
                    p-block element atom 23924
                      carbon group element atom 23656
                        carbon atom 23612
                          organic molecular entity 23612
                            organic group 22086
                              organic divalent group 22060
                                organodiyl group 22060
                                  carbonyl group 22035
                                    carbonyl compound 22035
                                      ketone 18148
                                        oxyketone 9170
                                          alpha-oxyketone 9170
                                            alpha-hydroxy ketone 9170
                                              tertiary alpha-hydroxy ketone 8884
                                                berkeleyone A 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.