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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:(+)-secoisolariciresinol
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Accession:CHEBI:67247 term browser browse the term
Definition:An enantiomer of secoisolariciresinol having (+)-(2S,3S)-configuration.
Synonyms:exact_synonym: (2S,3S)-2,3-bis(4-hydroxy-3-methoxybenzyl)butane-1,4-diol
 related_synonym: Formula=C20H26O6;   InChI=1S/C20H26O6/c1-25-19-9-13(3-5-17(19)23)7-15(11-21)16(12-22)8-14-4-6-18(24)20(10-14)26-2/h3-6,9-10,15-16,21-24H,7-8,11-12H2,1-2H3/t15-,16-/m1/s1;   InChIKey=PUETUDUXMCLALY-HZPDHXFCSA-N;   SMILES=COc1cc(C[C@H](CO)[C@@H](CO)Cc2ccc(O)c(OC)c2)ccc1O
 xref: MetaCyc:CPD-8910;   PMID:8262939;   Reaxys:3220852;   Wikipedia:Secoisolariciresinol
 cyclic_relationship: is_enantiomer_of CHEBI:65004


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19817
    role 19767
      application 19445
        pro-agent 8876
          prodrug 8630
            butane-1,4-diol 62
              secoisolariciresinol 1
                (+)-secoisolariciresinol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19817
    subatomic particle 19815
      composite particle 19815
        hadron 19815
          baryon 19815
            nucleon 19815
              atomic nucleus 19815
                atom 19815
                  main group element atom 19705
                    p-block element atom 19705
                      chalcogen 19407
                        oxygen atom 19368
                          oxygen molecular entity 19368
                            hydroxides 19094
                              organic hydroxy compound 18659
                                polyol 7822
                                  diol 2727
                                    butanediols 144
                                      butanediol 66
                                        butane-1,4-diol 62
                                          secoisolariciresinol 1
                                            (+)-secoisolariciresinol 0
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