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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:(-)-glyceollin II
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Accession:CHEBI:52127 term browser browse the term
Definition:A benzofuropyranochromene that is 3H,7H-[1]benzofuro[3,2-c]pyrano[3,2-g]chromene substituted at positions 7a and 10 by hydroxy groups and at position 3 by a gem-dimethyl group.
Synonyms:exact_synonym: (7S,12aS)-3,3-dimethyl-3H,7H-[1]benzofuro[3,2-c]pyrano[3,2-g]chromene-7a,10(12aH)-diol
 related_synonym: Formula=C20H18O5;   InChI=1S/C20H18O5/c1-19(2)6-5-11-7-13-16(9-15(11)25-19)23-10-20(22)14-4-3-12(21)8-17(14)24-18(13)20/h3-9,18,21-22H,10H2,1-2H3/t18-,20+/m0/s1;   InChIKey=DDJVLBCETGUEBO-AZUAARDMSA-N;   SMILES=[H][C@@]12Oc3cc(O)ccc3[C@]1(O)COc1cc3OC(C)(C)C=Cc3cc21
 alt_id: CHEBI:52085;   CHEBI:91
 xref: AGR:GUA85013620;   Beilstein:1664105;   CAS:67314-98-1;   KEGG:C10422;   KNApSAcK:C00002531;   Patent:US2011144195;   Patent:WO2009111428;   Patent:WO2012006750;   Reaxys:1664105


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Term Annotations click to browse term
  CHEBI ontology 19932
    role 19904
      biological role 19902
        poison 18673
          toxin 16002
            phytotoxin 6453
              phytoalexin 6441
                (-)-glyceollin II 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19932
    subatomic particle 19930
      composite particle 19930
        hadron 19930
          baryon 19930
            nucleon 19930
              atomic nucleus 19930
                atom 19930
                  main group element atom 19876
                    p-block element atom 19876
                      carbon group element atom 19816
                        carbon atom 19812
                          organic molecular entity 19812
                            organic molecule 19764
                              organic cyclic compound 19553
                                organic heterocyclic compound 18905
                                  organic heteropolycyclic compound 18317
                                    organic heteropentacyclic compound 13576
                                      benzofuropyranochromene 0
                                        (-)-glyceollin II 0
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