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CHEBI:185213 - 3',5,6-Trihydroxy-3,4',7,8-tetramethoxyflavone 3-glucoside

ChEBI IDCHEBI:185213
ChEBI Name3',5,6-Trihydroxy-3,4',7,8-tetramethoxyflavone 3-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H28O14
Net Charge0
Average Mass552.485
Monoisotopic Mass552.14791
SMILESCOc1cc(-c2oc3c(OC)c(O)c(OC)c(OC)c3c(=O)c2OC2OC(CO)C(O)C(O)C2O)ccc1O
InChIInChI=1S/C25H28O14/c1-33-11-7-9(5-6-10(11)27)19-24(39-25-17(31)16(30)14(28)12(8-26)37-25)15(29)13-20(34-2)22(35-3)18(32)23(36-4)21(13)38-19/h5-7,12,14,16-17,25-28,30-32H,8H2,1-4H3
InChIKeyHGPJRAPODVOCLC-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)
3',5,6-Trihydroxy-3,4',7,8-tetramethoxyflavone 3-glucoside (CHEBI:185213) is a flavonoids (CHEBI:72544)
3',5,6-Trihydroxy-3,4',7,8-tetramethoxyflavone 3-glucoside (CHEBI:185213) is a glycoside (CHEBI:24400)
IUPAC Name 
7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-5,6,8-trimethoxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Manual XrefsDatabases
HMDB0040506HMDB