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CHEBI:190832 - 6-(5-{8-[1-(2,4-dihydroxyphenyl)-2-hydroxy-3-(3-hydroxyphenyl)propyl]-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl}-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

ChEBI IDCHEBI:190832
ChEBI Name6-(5-{8-[1-(2,4-dihydroxyphenyl)-2-hydroxy-3-(3-hydroxyphenyl)propyl]-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl}-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H36O16
Net Charge0
Average Mass724.668
Monoisotopic Mass724.20034
SMILESO=C(O)C1OC(Oc2cc(C3Oc4c(c(O)cc(O)c4C(c4ccc(O)cc4O)C(O)Cc4cccc(O)c4)CC3O)ccc2O)C(O)C(O)C1O
InChIInChI=1S/C36H36O16/c37-16-3-1-2-14(8-16)9-23(42)27(18-6-5-17(38)11-21(18)40)28-24(43)13-22(41)19-12-25(44)32(51-33(19)28)15-4-7-20(39)26(10-15)50-36-31(47)29(45)30(46)34(52-36)35(48)49/h1-8,10-11,13,23,25,27,29-32,34,36-47H,9,12H2,(H,48,49)
InChIKeyFOSLDXWNNCSSJU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) root (BTO:0001188) MetaboLights (MTBLS4362)
ChEBI Ontology
Outgoing Relation(s)
6-(5-{8-[1-(2,4-dihydroxyphenyl)-2-hydroxy-3-(3-hydroxyphenyl)propyl]-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl}-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid (CHEBI:190832) is a flavonoids (CHEBI:72544)
6-(5-{8-[1-(2,4-dihydroxyphenyl)-2-hydroxy-3-(3-hydroxyphenyl)propyl]-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl}-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid (CHEBI:190832) is a β-D-glucosiduronic acid (CHEBI:15341)
IUPAC Name 
6-[5-[8-[1-(2,4-dihydroxyphenyl)-2-hydroxy-3-(3-hydroxyphenyl)propyl]-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]-2-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0135114HMDB