CHEBI:193533 - 3,4,5-trihydroxy-6-{[5-methoxy-2,2-dimethyl-6-(3-oxo-3-phenylprop-1-en-1-yl)-2H-chromen-7-yl]oxy}oxane-2-carboxylic acid

ChEBI IDCHEBI:193533
ChEBI Name3,4,5-trihydroxy-6-{[5-methoxy-2,2-dimethyl-6-(3-oxo-3-phenylprop-1-en-1-yl)-2H-chromen-7-yl]oxy}oxane-2-carboxylic acid
Stars
Submittermwilliams
DownloadsMolfile
FormulaC27H28O10
Net Charge0
Average Mass512.511
Monoisotopic Mass512.16825
SMILESCOc1c2c(cc(OC3OC(C(=O)O)C(O)C(O)C3O)c1/C=C/C(=O)c1ccccc1)OC(C)(C)C=C2
InChIInChI=1S/C27H28O10/c1-27(2)12-11-16-19(37-27)13-18(35-26-22(31)20(29)21(30)24(36-26)25(32)33)15(23(16)34-3)9-10-17(28)14-7-5-4-6-8-14/h4-13,20-22,24,26,29-31H,1-3H3,(H,32,33)/b10-9+
InChIKeyZFPMCZDHUDDAGD-MDZDMXLPSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
3,4,5-trihydroxy-6-{[5-methoxy-2,2-dimethyl-6-(3-oxo-3-phenylprop-1-en-1-yl)-2H-chromen-7-yl]oxy}oxane-2-carboxylic acid (CHEBI:193533) is a flavonoids (CHEBI:72544)
3,4,5-trihydroxy-6-{[5-methoxy-2,2-dimethyl-6-(3-oxo-3-phenylprop-1-en-1-yl)-2H-chromen-7-yl]oxy}oxane-2-carboxylic acid (CHEBI:193533) is a glycoside (CHEBI:24400)