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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:6-linalyl-2-O,3-dimethylflaviolin
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Accession:CHEBI:82610 term browser browse the term
Definition:A hydroxy-1,4-naphthoquinone that is 2-O-methylflaviolin in which the hydrogens at positions 3 and 6 are replaced by methyl and linalyl groups respectively.
Synonyms:exact_synonym: 6-(3,7-dimethylocta-1,6-dien-3-yl)-5,7-dihydroxy-2-methoxy-3-methyl-1,4-naphthoquinone
 related_synonym: Formula=C22H26O5;   InChI=1S/C22H26O5/c1-7-22(5,10-8-9-12(2)3)17-15(23)11-14-16(20(17)26)18(24)13(4)21(27-6)19(14)25/h7,9,11,23,26H,1,8,10H2,2-6H3;   InChIKey=VOXTWWMONIHUIK-UHFFFAOYSA-N;   SMILES=COC1=C(C)C(=O)c2c(O)c(c(O)cc2C1=O)C(C)(CCC=C(C)C)C=C
 xref: MetaCyc:CPD-16659;   PMID:20937800;   Reaxys:21763058
 cyclic_relationship: is_conjugate_acid_of CHEBI:78588


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  CHEBI ontology 495
    role 495
      biological role 495
        biochemical role 455
          metabolite 446
            prokaryotic metabolite 392
              bacterial metabolite 392
                6-linalyl-2-O,3-dimethylflaviolin 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 495
    subatomic particle 495
      composite particle 495
        hadron 495
          baryon 495
            nucleon 495
              atomic nucleus 495
                atom 495
                  main group element atom 488
                    p-block element atom 488
                      carbon group element atom 477
                        carbon atom 476
                          organic molecular entity 476
                            heteroorganic entity 472
                              organochalcogen compound 426
                                organooxygen compound 424
                                  carbonyl compound 400
                                    ketone 48
                                      cyclic ketone 44
                                        quinone 6
                                          naphthoquinone 1
                                            1,4-naphthoquinones 1
                                              hydroxy-1,4-naphthoquinone 0
                                                flaviolin 0
                                                  6-linalyl-2-O,3-dimethylflaviolin 0
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