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ONTOLOGY REPORT - ANNOTATIONS


Term:(-)-5'-desmethylyatein
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Accession:CHEBI:90894 term browser browse the term
Definition:A butan-4-olide that is (-)-bursehernin bearing an additional hydroxy substituent at position 5 (adjacent to the two methoxy groups).
Synonyms:exact_synonym: (R,4R)-4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(3-hydroxy-4,5-dimethoxyphenyl)methyl]oxolan-2-one
 related_synonym: (-)-3-desmethylyatein;   (-)-5'-demethylyatein;   3-demethylyatein;   Formula=C21H22O7;   InChI=1S/C21H22O7/c1-24-19-9-13(7-16(22)20(19)25-2)6-15-14(10-26-21(15)23)5-12-3-4-17-18(8-12)28-11-27-17/h3-4,7-9,14-15,22H,5-6,10-11H2,1-2H3/t14-,15+/m0/s1;   InChIKey=PFCOJAPJHVVASV-LSDHHAIUSA-N;   SMILES=C([C@@H]1[C@H](COC1=O)CC2=CC=C3OCOC3=C2)C4=CC(=C(C(=C4)O)OC)OC
 xref: MetaCyc:CPD-18755;   PMID:26359402;   Reaxys:4886287


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Term Annotations click to browse term
  CHEBI ontology 19790
    role 19738
      biological role 19737
        biochemical role 19232
          metabolite 19208
            eukaryotic metabolite 18822
              plant metabolite 17320
                (-)-5'-desmethylyatein 0
Path 2
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  CHEBI ontology 19790
    subatomic particle 19788
      composite particle 19788
        hadron 19788
          baryon 19788
            nucleon 19788
              atomic nucleus 19788
                atom 19788
                  main group element atom 19674
                    p-block element atom 19674
                      carbon group element atom 19572
                        carbon atom 19561
                          organic molecular entity 19561
                            organic group 18475
                              organic divalent group 18468
                                organodiyl group 18468
                                  carbonyl group 18366
                                    carbonyl compound 18366
                                      carboxylic ester 14074
                                        lactone 5923
                                          gamma-lactone 1214
                                            butan-4-olide 299
                                              (-)-pluviatolide 0
                                                (-)-bursehernin 0
                                                  (-)-5'-desmethylyatein 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.