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ONTOLOGY REPORT - ANNOTATIONS


Term:demethylzeylasteral
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Accession:CHEBI:132314 term browser browse the term
Definition:A carbopolycyclic compound with formula C29H36O6, originally isolated from Tripterygium wilfordii.
Synonyms:exact_synonym: (2R,4aS,6aS,12bR,14aS,14bR)-9-formyl-10,11-dihydroxy-2,4a,6a,12b,14a-pentamethyl-8-oxo-1,2,3,4,4a,5,6,6a,8,12b,13,14,14a,14b-tetradecahydropicene-2-carboxylic acid
 related_synonym: Formula=C29H36O6;   InChI=1S/C29H36O6/c1-25-6-7-26(2,24(34)35)14-21(25)29(5)11-9-27(3)17-12-19(32)23(33)16(15-30)22(17)18(31)13-20(27)28(29,4)10-8-25/h12-13,15,21,32-33H,6-11,14H2,1-5H3,(H,34,35)/t21-,25-,26-,27+,28-,29+/m1/s1;   InChIKey=ZDZSFWLPCFRASW-CPISFEQASA-N;   SMILES=O=C1C=C2[C@@]3([C@]([C@]4([C@@](CC3)(CC[C@](C4)(C(=O)O)C)C)[H])(CC[C@]2(C=5C1=C(C(O)=C(O)C5)C([H])=O)C)C)C
 xref: CAS:107316-88-1 "KNApSAcK";   KNApSAcK:C00030109;   PMID:12600689 "Europe PMC";   PMID:19383554 "Europe PMC";   PMID:22874791 "Europe PMC";   PMID:23807732 "Europe PMC";   PMID:26208003 "Europe PMC";   PMID:27259309 "Europe PMC";   PMID:8658703 "Europe PMC";   Pubchem:10322911 "SUBMITTER";   Reaxys:6756771 "Reaxys"


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  CHEBI ontology 19679
    role 19623
      application 19246
        anti-inflammatory agent 14919
          demethylzeylasteral 0
Path 2
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  CHEBI ontology 19679
    subatomic particle 19675
      composite particle 19675
        hadron 19675
          baryon 19675
            nucleon 19675
              atomic nucleus 19675
                atom 19675
                  main group element atom 19555
                    p-block element atom 19555
                      carbon group element atom 19438
                        carbon atom 19430
                          organic molecular entity 19430
                            organic group 18351
                              organic divalent group 18340
                                organodiyl group 18340
                                  carbonyl group 18225
                                    carbonyl compound 18225
                                      carboxylic acid 17930
                                        carboacyl group 16948
                                          univalent carboacyl group 16948
                                            formyl group 7681
                                              aldehyde 7681
                                                arenecarbaldehyde 123
                                                  demethylzeylasteral 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.