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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:Vicenin-1 6''-O-acetate
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Accession:CHEBI:169520 term browser browse the term
Synonyms:exact_synonym: [(3S,4R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-6-[(2S,4S,5R)-3,4,5-trihydroxyoxan-2-yl]chromen-8-yl]-3,4,5-trihydroxyoxan-2-yl]methyl acetate
 related_synonym: Formula=C28H30O15;   InChI=1S/C28H30O15/c1-9(29)40-8-15-20(34)23(37)25(39)28(43-15)18-22(36)17(27-24(38)19(33)13(32)7-41-27)21(35)16-12(31)6-14(42-26(16)18)10-2-4-11(30)5-3-10/h2-6,13,15,19-20,23-25,27-28,30,32-39H,7-8H2,1H3/t13-,15?,19+,20-,23+,24?,25?,27+,28+/m1/s1;   InChIKey=AIQCDEJOKQHKMO-MSLHOYQASA-N;   SMILES=O1[C@](C(O)[C@@H](O)[C@H](O)C1COC(=O)C)(C=2C(O)=C([C@@]3(OC[C@@H](O)[C@H](O)C3O)[H])C(O)=C4C2OC(=CC4=O)C5=CC=C(O)C=C5)[H]
 xref: Chemspider:24843337;   LIPID_MAPS_instance:LMPK12110283

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Path 1
Term Annotations click to browse term
  CHEBI ontology 0
    chemical entity 0
      atom 0
        nonmetal atom 0
          oxygen atom 0
            oxygen molecular entity 0
              flavonoids 0
                Vicenin-1 6''-O-acetate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbohydrates and carbohydrate derivatives 0
                                    carbohydrate 0
                                      carbohydrate derivative 0
                                        glycosyl compound 0
                                          C-glycosyl compound 0
                                            Vicenin-1 6''-O-acetate 0
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