CHEBI:78590 - 7-O-geranyl-2-O,3-dimethylflaviolin

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ChEBI Name 7-O-geranyl-2-O,3-dimethylflaviolin ChEBI ID CHEBI:78590 ChEBI ASCII Name 7-O-geranyl-2-O,3-dimethylflaviolin Definition A hydroxy-1,4-naphthoquinone that is 3-methylflaviolin in which the hydroxyl hydrogens at positions 2 and 7 are replaced by methyl and geranyl groups respectively. Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C22H26O5 Net Charge 0 Average Mass 370.43880 Monoisotopic Mass 370.17802 InChI InChI=1S/C22H26O5/c1-13(2)7-6-8-14(3)9-10-27-16-11-17-19(18(23)12-16)20(24)15(4)22(26-5)21(17)25/h7,9,11-12,23H,6,8,10H2,1-5H3/b14-9+ InChIKey JSICQLYEVMVRNL-NTEUORMPSA-N SMILES COC1=C(C)C(=O)c2c(O)cc(OC\C=C(/C)CCC=C(C)C)cc2C1=O Roles Classification Biological Role(s): bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. View more via ChEBI Ontology ChEBI Ontology Outgoing 7-O-geranyl-2-O,3-dimethylflaviolin (CHEBI:78590) has functional parent flaviolin (CHEBI:42646) 7-O-geranyl-2-O,3-dimethylflaviolin (CHEBI:78590) has role bacterial metabolite (CHEBI:76969) 7-O-geranyl-2-O,3-dimethylflaviolin (CHEBI:78590) is a enol ether (CHEBI:47985) 7-O-geranyl-2-O,3-dimethylflaviolin (CHEBI:78590) is a hydroxy-1,4-naphthoquinone (CHEBI:132157) 7-O-geranyl-2-O,3-dimethylflaviolin (CHEBI:78590) is a olefinic compound (CHEBI:78840) 7-O-geranyl-2-O,3-dimethylflaviolin (CHEBI:78590) is a phenols (CHEBI:33853) IUPAC Name 7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-5-hydroxy-2-methoxy-3-methyl-1,4-naphthoquinone Synonyms Sources 7-O-geranyl-2-O,3-dimethylflaviolin UniProt 7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-5-hydroxy-2-methoxy-3-methylnaphthalene-1,4-dione SUBMITTER Manual Xref Database CPD-16662 MetaCyc View more database links Registry Number Type Source 21763057 Reaxys Registry Number Reaxys Citation Type Source 20937800 PubMed citation Europe PMC Last Modified 09 June 2016