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CHEBI:205778 - 5-hydroxy-7-(hydroxymethyl)-2-methoxy-6-methylnaphthalene-1,4-dione

ChEBI IDCHEBI:205778
ChEBI Name5-hydroxy-7-(hydroxymethyl)-2-methoxy-6-methylnaphthalene-1,4-dione
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SubmitterMetaboLights
DownloadsMolfile
FormulaC13H12O5
Net Charge0
Average Mass248.234
Monoisotopic Mass248.06847
SMILESCOC1=CC(=O)c2c(cc(CO)c(C)c2O)C1=O
InChIInChI=1S/C13H12O5/c1-6-7(5-14)3-8-11(12(6)16)9(15)4-10(18-2)13(8)17/h3-4,14,16H,5H2,1-2H3
InChIKeyRKQMBVRWHQMNSZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-hydroxy-7-(hydroxymethyl)-2-methoxy-6-methylnaphthalene-1,4-dione (CHEBI:205778) is a naphthoquinone (CHEBI:25481)
IUPAC Name 
5-hydroxy-7-(hydroxymethyl)-2-methoxy-6-methylnaphthalene-1,4-dione
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9775999ChemSpider