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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:7-hydroxysecoisolariciresinol
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Accession:CHEBI:88362 term browser browse the term
Definition:A polyphenol that is (-)-secoisolariciresinol carrying an additional hydroxy substituent at position 7.
Synonyms:exact_synonym: (2R,3R)-1-(4-hydroxy-3-methoxyphenyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]-2-(hydroxymethyl)butane-1,4-diol
 related_synonym: Formula=C20H26O7;   InChI=1S/C20H26O7/c1-26-18-8-12(3-5-16(18)23)7-14(10-21)15(11-22)20(25)13-4-6-17(24)19(9-13)27-2/h3-6,8-9,14-15,20-25H,7,10-11H2,1-2H3/t14-,15-,20?/m0/s1;   InChIKey=VPDBTIFHPUYJJJ-HGUAOMBGSA-N;   SMILES=C1=C(C(=CC=C1C([C@H]([C@@H](CC2=CC=C(C(=C2)OC)O)CO)CO)O)O)OC
 xref: Reaxys:9225754


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19853
    role 19804
      application 19477
        pro-agent 8870
          prodrug 8625
            butane-1,4-diol 63
              secoisolariciresinol 1
                (-)-secoisolariciresinol 1
                  7-hydroxysecoisolariciresinol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19853
    subatomic particle 19851
      composite particle 19851
        hadron 19851
          baryon 19851
            nucleon 19851
              atomic nucleus 19851
                atom 19851
                  main group element atom 19744
                    p-block element atom 19744
                      chalcogen 19438
                        oxygen atom 19400
                          oxygen molecular entity 19400
                            hydroxides 19123
                              organic hydroxy compound 18678
                                polyol 7812
                                  diol 2722
                                    butanediols 144
                                      butanediol 67
                                        butane-1,4-diol 63
                                          secoisolariciresinol 1
                                            (-)-secoisolariciresinol 1
                                              7-hydroxysecoisolariciresinol 0
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