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CHEBI:210801 - Cytosporaquinone D

ChEBI IDCHEBI:210801
ChEBI NameCytosporaquinone D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H20O6
Net Charge0
Average Mass392.407
Monoisotopic Mass392.12599
SMILESCC(C)=CCOc1ccc(C2=C(O)C(=O)C(c3ccc(O)cc3)=C(O)C2=O)cc1
InChIInChI=1S/C23H20O6/c1-13(2)11-12-29-17-9-5-15(6-10-17)19-22(27)20(25)18(21(26)23(19)28)14-3-7-16(24)8-4-14/h3-11,24-25,28H,12H2,1-2H3
InChIKeyYYRUVXBPSHMMJH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Cytospora (ncbitaxon:117544) - PubMed (30807789)
ChEBI Ontology
Outgoing Relation(s)
Cytosporaquinone D (CHEBI:210801) is a aromatic ether (CHEBI:35618)
IUPAC Name 
2,5-dihydroxy-3-(4-hydroxyphenyl)-6-[4-(3-methylbut-2-enoxy)phenyl]cyclohexa-2,5-diene-1,4-dione