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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:65004 term browser browse the term
Definition:An enantiomer of secoisolariciresinol having (-)-(2R,3R)-configuration.
Synonyms:exact_synonym: (2R,3R)-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-/m0/s1;   InChIKey=PUETUDUXMCLALY-HOTGVXAUSA-N;   SMILES=COc1cc(C[C@@H](CO)[C@H](CO)Cc2ccc(O)c(OC)c2)ccc1O
 xref: CAS:29388-59-8;   HMDB:HMDB0013692;   KEGG:C18167;   LINCS:LSM-5964
 xref_mesh: MESH:C060283
 xref: MetaCyc:CPD-8909;   PMID:15653677;   PMID:21837520;   PMID:21897049;   PMID:21958542;   PMID:22030618;   PMID:22037685;   PMID:22476613;   Reaxys:1893026
 cyclic_relationship: is_enantiomer_of CHEBI:67247


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 0
    role 0
      application 0
        pro-agent 0
          prodrug 0
            butane-1,4-diol 0
              secoisolariciresinol 0
                (-)-secoisolariciresinol 0
                  7-hydroxysecoisolariciresinol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      chalcogen 0
                        oxygen atom 0
                          oxygen molecular entity 0
                            hydroxides 0
                              organic hydroxy compound 0
                                polyol 0
                                  diol 0
                                    butanediols 0
                                      butanediol 0
                                        butane-1,4-diol 0
                                          secoisolariciresinol 0
                                            (-)-secoisolariciresinol 0
                                              7-hydroxysecoisolariciresinol 0
paths to the root