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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:agatharesinol
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Accession:CHEBI:53627 term browser browse the term
Definition:A major heartwood norlignan characterised by a core trans-3-p-hydroxyphenyl-1-phenylpropene structural unit.
Synonyms:exact_synonym: (2S,3S,4E)-3,5-bis(4-hydroxyphenyl)pent-4-ene-1,2-diol
 related_synonym: Formula=C17H18O4;   InChI=1S/C17H18O4/c18-11-17(21)16(13-4-8-15(20)9-5-13)10-3-12-1-6-14(19)7-2-12/h1-10,16-21H,11H2/b10-3+/t16-,17+/m0/s1;   InChIKey=DVUXXXYVVWRAIA-UDEVJOAWSA-N;   SMILES=OC[C@@H](O)[C@@H](\\C=C\\c1ccc(O)cc1)c1ccc(O)cc1
 xref: AGR:IND43625572;   AGR:IND43788726;   AGR:IND43826632;   Beilstein:2336768;   PMID:11371016;   PMID:11684179;   PMID:12052511;   PMID:16473652;   PMID:16884819;   PMID:17169901;   PMID:17191998;   PMID:23157009;   Reaxys:2336768



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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19823
    role 19773
      biological role 19773
        biochemical role 19390
          metabolite 19367
            eukaryotic metabolite 19054
              plant metabolite 17458
                norlignan 4
                  agatharesinol 0
                    sequirin C 0
                    sugiresinol + 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19823
    subatomic particle 19821
      composite particle 19821
        hadron 19821
          baryon 19821
            nucleon 19821
              atomic nucleus 19821
                atom 19821
                  main group element atom 19720
                    p-block element atom 19720
                      p-block molecular entity 19720
                        carbon group molecular entity 19643
                          organic molecular entity 19633
                            organic molecule 19572
                              organic cyclic compound 19366
                                organic aromatic compound 19191
                                  phenylpropanoid 9548
                                    norlignan 4
                                      agatharesinol 0
                                        sequirin C 0
                                        sugiresinol + 0
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