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CHEBI:186826 - 6,7-Dihydroxy-5,4'-dimethoxy-flavylium

ChEBI IDCHEBI:186826
ChEBI Name6,7-Dihydroxy-5,4'-dimethoxy-flavylium
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H17O5
Net Charge+1
Average Mass301.318
Monoisotopic Mass301.10705
SMILESCOC1=C(O)C(O)C=C2[O+]=C(c3ccc(OC)cc3)C=CC21
InChIInChI=1S/C17H16O5/c1-20-11-5-3-10(4-6-11)14-8-7-12-15(22-14)9-13(18)16(19)17(12)21-2/h3-9,12-13,18H,1-2H3/p+1
InChIKeyXPZAWRNPMRAKDD-UHFFFAOYSA-O
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
6,7-Dihydroxy-5,4'-dimethoxy-flavylium (CHEBI:186826) is a methoxybenzenes (CHEBI:51683)
IUPAC Name 
5-methoxy-2-(4-methoxyphenyl)-4a,7-dihydrochromen-1-ium-6,7-diol
Manual XrefsDatabases
24842483ChemSpider
LMPK12010441LIPID MAPS