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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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  CHEBI ontology 853
    role 831
      biological role 831
        biochemical role 705
          metabolite 689
            12-methyl-5-dehydroacetylhorminone 0
Path 2
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  CHEBI ontology 853
    subatomic particle 838
      composite particle 838
        hadron 838
          baryon 838
            nucleon 838
              atomic nucleus 838
                atom 838
                  main group element atom 826
                    p-block element atom 823
                      carbon group element atom 796
                        carbon atom 792
                          organic molecular entity 792
                            organic group 372
                              organic divalent group 370
                                organodiyl group 370
                                  carbonyl group 369
                                    carbonyl compound 369
                                      ketone 175
                                        cyclic ketone 159
                                          quinone 18
                                            hydroxyquinone 2
                                              horminone 0
                                                12-methyl-5-dehydrohorminone 0
                                                  12-methyl-5-dehydroacetylhorminone 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.