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ONTOLOGY REPORT - ANNOTATIONS


Term:(+)-sesamin monocatechol
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Accession:CHEBI:136542 term browser browse the term
Definition:A catechol resulting from the hydrolysis of one of the two methylene acetal groups in (+)-sesamin. Found as a product of (+)-sesamin in rat liver homogenate and also produced from sesamin by an enzyme (SesA) found in Sinomonas species. no. 22 growing on sesamin.
Synonyms:exact_synonym: 4-[(1S,3aR,4S,6aR)-4-(1,3-benzodioxol-5-yl)tetrahydro-1H,3H-furo[3,4-c]furan-1-yl]benzene-1,2-diol
 related_synonym: (1R,2S,5R,6S)-6-(3,4-dihydroxyphenyl)-2-(3,4-methylenedioxyphenyl)-3,7-dioxabicyclo[3,3,0]octane;   Formula=C19H18O6;   InChI=1S/C19H18O6/c20-14-3-1-10(5-15(14)21)18-12-7-23-19(13(12)8-22-18)11-2-4-16-17(6-11)25-9-24-16/h1-6,12-13,18-21H,7-9H2/t12-,13-,18+,19+/m0/s1;   InChIKey=CGEORJKFOZSMEZ-MBZVMHRFSA-N;   SC-1;   SMILES=C1=C2OCOC2=CC(=C1)[C@]3(OC[C@]4([C@@]3(CO[C@@]4(C5=CC=C(C(=C5)O)O)[H])[H])[H])[H]
 xref: MetaCyc:CPD-19800;   PMID:12617602 "Europe PMC";   PMID:16597711 "Europe PMC";   PMID:18981616 "Europe PMC";   PMID:21622626 "Europe PMC";   PMID:22752007 "Europe PMC";   PMID:27444012 "SUBMITTER";   Reaxys:7388976 "Reaxys"


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  CHEBI ontology 834
    role 811
      biological role 811
        aetiopathogenetic role 421
          genotoxin 202
            catechol 1
              (+)-sesamin monocatechol 0
                (+)-sesamin dicatechol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 834
    subatomic particle 818
      composite particle 818
        hadron 818
          baryon 818
            nucleon 818
              atomic nucleus 818
                atom 818
                  main group element atom 806
                    p-block element atom 803
                      carbon group element atom 774
                        carbon atom 770
                          organic molecular entity 770
                            organic molecule 687
                              organic cyclic compound 612
                                organic aromatic compound 507
                                  phenols 391
                                    benzenediols 287
                                      catechols 13
                                        catechol 1
                                          (+)-sesamin monocatechol 0
                                            (+)-sesamin dicatechol 0
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