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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:isoscutellarein glycoside
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Accession:CHEBI:66085 term browser browse the term
Definition:A C-glycosyl compound that is isoscutellarein attached to a beta-D-glucopyranosyl moiety at position 6 via a C-glycosidic linkage. Isolated from the rhizomes of Iris pseudopumila, it exhibits antioxidant activity.
Synonyms:exact_synonym: (1S)-1,5-anhydro-1-[5,7,8-trihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl]-D-glucitol
 related_synonym: Formula=C21H20O11;   InChI=1S/C21H20O11/c22-6-11-14(25)17(28)19(30)21(32-11)13-15(26)12-9(24)5-10(7-1-3-8(23)4-2-7)31-20(12)18(29)16(13)27/h1-5,11,14,17,19,21-23,25-30H,6H2/t11-,14-,17+,19-,21+/m1/s1;   InChIKey=RKEQWDAUYLDNEU-DSTJRUDUSA-N;   SMILES=[H][C@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1c(O)c(O)c2oc(cc(=O)c2c1O)-c1ccc(O)cc1;   isoscutellarein-6-C-beta-D-glucopyranoside
 xref: PMID:17315314;   Reaxys:11109929


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  CHEBI ontology 19877
    role 19827
      chemical role 19342
        antioxidant 14252
          isoscutellarein glycoside 0
Path 2
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  CHEBI ontology 19877
    subatomic particle 19875
      composite particle 19875
        hadron 19875
          baryon 19875
            nucleon 19875
              atomic nucleus 19875
                atom 19875
                  main group element atom 19765
                    p-block element atom 19765
                      carbon group element atom 19670
                        carbon atom 19659
                          organic molecular entity 19659
                            organic molecule 19589
                              organic cyclic compound 19398
                                organic heterocyclic compound 18511
                                  oxacycle 17301
                                    benzopyran 10165
                                      1-benzopyran 9881
                                        flavonoid 6383
                                          flavones 4174
                                            hydroxyflavone 4162
                                              trihydroxyflavone 341
                                                apigenin 231
                                                  isoscutellarein 0
                                                    isoscutellarein glycoside 0
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