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ONTOLOGY REPORT - ANNOTATIONS


Term:12-methyl-5-dehydroacetylhorminone
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Accession:CHEBI:66365 term browser browse the term
Definition:An abietane diterpenoid that is the acetate ester of 12-methyl-5-dehydrohorminone. Isolated from the roots of Salvia multicaulis, it exhibits antitubercular activity.
Synonyms:exact_synonym: (7alpha)-12-methoxy-11,14-dioxoabieta-5,8,12-trien-7-yl acetate
 related_synonym: Formula=C23H30O5;   InChI=1S/C23H30O5/c1-12(2)16-19(25)17-14(28-13(3)24)11-15-22(4,5)9-8-10-23(15,6)18(17)20(26)21(16)27-7/h11-12,14H,8-10H2,1-7H3/t14-,23+/m1/s1;   InChIKey=KRHKKRFFQDNBIN-FATZIPQQSA-N;   SMILES=COC1=C(C(C)C)C(=O)C2=C(C1=O)[C@@]1(C)CCCC(C)(C)C1=C[C@H]2OC(C)=O;   [(4aS,9R)-6-methoxy-1,1,4a-trimethyl-5,8-dioxo-7-propan-2-yl-2,3,4,9-tetrahydrophenanthren-9-yl] acetate
 xref: PMID:9428161;   Reaxys:7890385


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Term Annotations click to browse term
  CHEBI ontology 24146
    role 24039
      biological role 24005
        biochemical role 23267
          metabolite 23169
            12-methyl-5-dehydroacetylhorminone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 24146
    subatomic particle 24100
      composite particle 24100
        hadron 24100
          baryon 24100
            nucleon 24100
              atomic nucleus 24100
                atom 24100
                  main group element atom 23929
                    p-block element atom 23929
                      carbon group element atom 23662
                        carbon atom 23618
                          organic molecular entity 23618
                            organic group 22089
                              organic divalent group 22063
                                organodiyl group 22063
                                  carbonyl group 22038
                                    carbonyl compound 22038
                                      ketone 18150
                                        cyclic ketone 14548
                                          quinone 8859
                                            hydroxyquinone 171
                                              horminone 0
                                                12-methyl-5-dehydrohorminone 0
                                                  12-methyl-5-dehydroacetylhorminone 0
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