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CHEBI:178128 - 3,3'-Bisjuglone

ChEBI IDCHEBI:178128
ChEBI Name3,3'-Bisjuglone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H10O6
Net Charge0
Average Mass346.294
Monoisotopic Mass346.04774
SMILESO=C1C=C(C2=CC(=O)c3cccc(O)c3C2=O)C(=O)c2c(O)cccc21
InChIInChI=1S/C20H10O6/c21-13-5-1-3-9-15(23)7-11(19(25)17(9)13)12-8-16(24)10-4-2-6-14(22)18(10)20(12)26/h1-8,21-22H
InChIKeyYSWLZVWSHJYBPI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Arisaema erubescens (ncbitaxon:228806) bulb (BTO:0000159) MetaboLights (MTBLS2858)
ChEBI Ontology
Outgoing Relation(s)
3,3'-Bisjuglone (CHEBI:178128) is a naphthoquinone (CHEBI:25481)
IUPAC Name 
8-hydroxy-2-(8-hydroxy-1,4-dioxonaphthalen-2-yl)naphthalene-1,4-dione
Manual XrefsDatabases
291952ChemSpider
HMDB0033936HMDB