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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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Term Annotations click to browse term
  CHEBI ontology 21322
    role 21309
      application 20768
        fuel 10474
          methanol 3093
            methyl ester 3082
              berkeleyone A 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 21322
    subatomic particle 21318
      composite particle 21318
        hadron 21318
          baryon 21318
            nucleon 21318
              atomic nucleus 21318
                atom 21318
                  main group element atom 21193
                    p-block element atom 21193
                      carbon group element atom 20991
                        carbon atom 20881
                          organic molecular entity 20881
                            organic group 19225
                              organic divalent group 19215
                                organodiyl group 19215
                                  carbonyl group 19189
                                    carbonyl compound 19189
                                      ketone 16338
                                        oxyketone 8766
                                          alpha-oxyketone 8766
                                            alpha-hydroxy ketone 8766
                                              tertiary alpha-hydroxy ketone 8483
                                                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.