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CHEBI:187809 - 6-Hydroxyluteolin 6,3'-dimethyl ether 7,4'-disulfate

ChEBI IDCHEBI:187809
ChEBI Name6-Hydroxyluteolin 6,3'-dimethyl ether 7,4'-disulfate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H14O13S2
Net Charge0
Average Mass490.420
Monoisotopic Mass489.98758
SMILESCOc1cc(-c2cc(=O)c3c(O)c(OC)c(OS(=O)(=O)O)cc3o2)ccc1OS(=O)(=O)O
InChIInChI=1S/C17H14O13S2/c1-26-12-5-8(3-4-10(12)29-31(20,21)22)11-6-9(18)15-13(28-11)7-14(30-32(23,24)25)17(27-2)16(15)19/h3-7,19H,1-2H3,(H,20,21,22)(H,23,24,25)
InChIKeyQFXPVCDOALBRGI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
6-Hydroxyluteolin 6,3'-dimethyl ether 7,4'-disulfate (CHEBI:187809) is a ether (CHEBI:25698)
6-Hydroxyluteolin 6,3'-dimethyl ether 7,4'-disulfate (CHEBI:187809) is a flavonoids (CHEBI:72544)
IUPAC Name 
[5-hydroxy-6-methoxy-2-(3-methoxy-4-sulooxyphenyl)-4-oxochromen-7-yl] hydrogen sulate
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24844160ChemSpider