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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:lilaline
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Accession:CHEBI:6461 term browser browse the term
Definition:A tetrahydroxyflavone that is flavone substituted by hydroxy groups at positions 3, 5, 7 and 4' and a 4-methyl-5-oxopyrrolidin-2-yl group at position 8.
Synonyms:exact_synonym: 3-methyl-5-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-8-yl]pyrrolidin-2-one
 related_synonym: Formula=C20H17NO7;   InChI=1S/C20H17NO7/c1-8-6-11(21-20(8)27)14-12(23)7-13(24)15-16(25)17(26)18(28-19(14)15)9-2-4-10(22)5-3-9/h2-5,7-8,11,22-24,26H,6H2,1H3,(H,21,27);   InChIKey=YDCRQLJCXBNURP-UHFFFAOYSA-N;   SMILES=CC1CC(NC1=O)c1c(O)cc(O)c2c1oc(-c1ccc(O)cc1)c(O)c2=O
 xref: CAS:110011-49-9;   KEGG:C10602;   KNApSAcK:C00002347;   Reaxys:6541427


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Term Annotations click to browse term
  CHEBI ontology 22210
    role 22195
      biological role 22194
        biochemical role 21464
          metabolite 21412
            eukaryotic metabolite 21270
              plant metabolite 19147
                lilaline 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22210
    subatomic particle 22202
      composite particle 22202
        hadron 22202
          baryon 22202
            nucleon 22202
              atomic nucleus 22202
                atom 22202
                  main group element atom 22136
                    p-block element atom 22136
                      carbon group element atom 21936
                        carbon atom 21861
                          organic molecular entity 21861
                            organic molecule 21678
                              organic cyclic compound 21285
                                organic heterocyclic compound 20357
                                  oxacycle 18880
                                    benzopyran 12208
                                      1-benzopyran 11965
                                        flavonoid 7264
                                          anthoxanthin 4596
                                            flavones 4596
                                              hydroxyflavone 4573
                                                flavonols 4463
                                                  7-hydroxyflavonol 4412
                                                    lilaline 0
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