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ONTOLOGY REPORT - ANNOTATIONS


Term:2,3-dihydro-3beta-methoxy withaferin A
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Accession:CHEBI:69121 term browser browse the term
Definition:A withanolide that is 2,3-dihydrowithaferin A substituted by a beta-methoxy group at position 3. It has been isolated from the aerial parts of Physalis longifolia.
Synonyms:exact_synonym: (3beta,4beta,5beta,6beta,22R)-4,27-dihydroxy-3-methoxy-5,6:22,26-diepoxyergost-24-ene-1,26-dione
 related_synonym: Formula=C29H42O7;   InChI=1S/C29H42O7/c1-14-10-21(35-26(33)17(14)13-30)15(2)18-6-7-19-16-11-24-29(36-24)25(32)22(34-5)12-23(31)28(29,4)20(16)8-9-27(18,19)3/h15-16,18-22,24-25,30,32H,6-13H2,1-5H3/t15-,16-,18+,19-,20-,21+,22-,24+,25-,27+,28-,29-/m0/s1;   InChIKey=MKTMIPAPOLDOQT-QAYSIJLNSA-N;   Quresimine A;   SMILES=CO[C@H]1CC(=O)[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3C[C@H]3O[C@@]23[C@H]1O)[C@H](C)[C@H]1CC(C)=C(CO)C(=O)O1
 xref: PMID:22098611 "Europe PMC";   Reaxys:6773328 "Reaxys"


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  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          metabolite 0
            2,3-dihydro-3beta-methoxy withaferin A 0
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  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 group 0
                              organic divalent group 0
                                organodiyl group 0
                                  carbonyl group 0
                                    carbonyl compound 0
                                      carboxylic ester 0
                                        lactone 0
                                          steroid lactone 0
                                            withanolide 0
                                              withaferin A 0
                                                2,3-dihydro-3beta-methoxy withaferin 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.