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CHEBI:190792 - 3,4,5-trihydroxy-6-{[2-(3-hydroxyphenyl)-5-methoxy-6,8-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}oxane-2-carboxylic acid

ChEBI IDCHEBI:190792
ChEBI Name3,4,5-trihydroxy-6-{[2-(3-hydroxyphenyl)-5-methoxy-6,8-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}oxane-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H26O11
Net Charge0
Average Mass490.461
Monoisotopic Mass490.14751
SMILESCOc1c(C)c(OC2OC(C(=O)O)C(O)C(O)C2O)c(C)c2c1C(=O)CC(c1cccc(O)c1)O2
InChIInChI=1S/C24H26O11/c1-9-19(34-24-18(29)16(27)17(28)22(35-24)23(30)31)10(2)21-15(20(9)32-3)13(26)8-14(33-21)11-5-4-6-12(25)7-11/h4-7,14,16-18,22,24-25,27-29H,8H2,1-3H3,(H,30,31)
InChIKeyJLBQQIIUCLCTGX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) root (BTO:0001188) MetaboLights (MTBLS4362)
ChEBI Ontology
Outgoing Relation(s)
3,4,5-trihydroxy-6-{[2-(3-hydroxyphenyl)-5-methoxy-6,8-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}oxane-2-carboxylic acid (CHEBI:190792) is a flavonoids (CHEBI:72544)
3,4,5-trihydroxy-6-{[2-(3-hydroxyphenyl)-5-methoxy-6,8-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}oxane-2-carboxylic acid (CHEBI:190792) is a glucosiduronic acid (CHEBI:24302)
IUPAC Name 
3,4,5-trihydroxy-6-[[2-(3-hydroxyphenyl)-5-methoxy-6,8-dimethyl-4-oxo-2,3-dihydrochromen-7-yl]oxy]oxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0130657HMDB