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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-O-(6-feruoylglucosyl)isoorientin
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Accession:CHEBI:75517 term browser browse the term
Definition:A C-glycosyl compound that is isoorientin in which the hydroxyl hydrogen at position 7 is replaced by a 6-feruloylglucosyl residue.
Synonyms:exact_synonym: (1S)-1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5-hydroxy-7-({6-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]-D-glucopyranosyl}oxy)-4-oxo-4N-chromen-6-yl]-D-glucitol
 related_synonym: Formula=C37H38O19;   InChI=1S/C37H38O19/c1-51-21-8-14(2-5-17(21)40)3-7-26(43)52-13-25-30(45)33(48)35(50)37(56-25)55-23-11-22-27(19(42)10-20(53-22)15-4-6-16(39)18(41)9-15)31(46)28(23)36-34(49)32(47)29(44)24(12-38)54-36/h2-11,24-25,29-30,32-41,44-50H,12-13H2,1H3/b7-3+/t24-,25-,29-,30-,32+,33+,34-,35-,36+,37?/m1/s1;   InChIKey=CRZJAZVDNXUPOH-STCLERKASA-N;   SMILES=COc1cc(ccc1O)\\C=C\\C(=O)OC[C@H]1OC(Oc2cc3oc(cc(=O)c3c(O)c2[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O
 xref: Reaxys:9607762


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  CHEBI ontology 400
    role 400
      chemical role 324
        antioxidant 36
          ferulic acid 0
            7-O-(6-feruoylglucosyl)isoorientin 0
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  CHEBI ontology 400
    subatomic particle 400
      composite particle 400
        hadron 400
          baryon 400
            nucleon 400
              atomic nucleus 400
                atom 400
                  main group element atom 393
                    p-block element atom 393
                      carbon group element atom 381
                        carbon atom 380
                          organic molecular entity 380
                            organic group 314
                              organic divalent group 313
                                organodiyl group 313
                                  carbonyl group 313
                                    carbonyl compound 313
                                      carboxylic acid 277
                                        monocarboxylic acid 89
                                          alpha,beta-unsaturated monocarboxylic acid 7
                                            cinnamic acids 0
                                              hydroxycinnamic acid 0
                                                monohydroxycinnamic acid 0
                                                  ferulic acids 0
                                                    ferulic acid 0
                                                      7-O-(6-feruoylglucosyl)isoorientin 0
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