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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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Term Annotations click to browse term
  CHEBI ontology 19764
    role 19711
      biological role 19710
        aetiopathogenetic role 18823
          genotoxin 16404
            catechol 294
              (+)-sesamin monocatechol 0
                (+)-sesamin dicatechol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19764
    subatomic particle 19762
      composite particle 19762
        hadron 19762
          baryon 19762
            nucleon 19762
              atomic nucleus 19762
                atom 19762
                  main group element atom 19646
                    p-block element atom 19646
                      carbon group element atom 19540
                        carbon atom 19529
                          organic molecular entity 19529
                            organic molecule 19447
                              organic cyclic compound 19207
                                organic aromatic compound 19039
                                  phenols 18104
                                    benzenediols 5343
                                      catechols 2258
                                        catechol 294
                                          (+)-sesamin monocatechol 0
                                            (+)-sesamin dicatechol 0
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