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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:3-linalylflaviolin
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Accession:CHEBI:79196 term browser browse the term
Definition:A hydroxy-1,4-naphthoquinone that is flaviolin in which the hydrogen at position 3 is replaced by a linalyl group.
Synonyms:exact_synonym: 3-(3,7-dimethylocta-1,6-dien-3-yl)-2,5,7-trihydroxy-1,4-naphthoquinone
 related_synonym: Formula=C20H22O5;   InChI=1S/C20H22O5/c1-5-20(4,8-6-7-11(2)3)16-18(24)15-13(17(23)19(16)25)9-12(21)10-14(15)22/h5,7,9-10,21-22,25H,1,6,8H2,2-4H3;   InChIKey=YLXGIQYXMIHMOL-UHFFFAOYSA-N;   SMILES=CC(C)=CCCC(C)(C=C)C1=C(O)C(=O)c2cc(O)cc(O)c2C1=O
 xref: MetaCyc:CPD-16656;   PMID:17543953
 cyclic_relationship: is_conjugate_acid_of CHEBI:78347


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Term Annotations click to browse term
  CHEBI ontology 19838
    role 19814
      biological role 19812
        biochemical role 19522
          metabolite 19509
            xenobiotic metabolite 15461
              bacterial xenobiotic metabolite 4174
                3-linalylflaviolin 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19838
    subatomic particle 19836
      composite particle 19836
        hadron 19836
          baryon 19836
            nucleon 19836
              atomic nucleus 19836
                atom 19836
                  main group element atom 19786
                    p-block element atom 19786
                      carbon group element atom 19734
                        carbon atom 19731
                          organic molecular entity 19731
                            heteroorganic entity 19488
                              organochalcogen compound 19251
                                organooxygen compound 19168
                                  carbonyl compound 18895
                                    ketone 17185
                                      cyclic ketone 15703
                                        quinone 8649
                                          naphthoquinone 1474
                                            1,4-naphthoquinones 1462
                                              hydroxy-1,4-naphthoquinone 157
                                                flaviolin 0
                                                  3-linalylflaviolin 0
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