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CHEBI:185937 - 6-(6-hydroxy-4-{5-[(E)-2-[6-hydroxy-3-(3-hydroxyphenyl)-2-phenyl-2,3-dihydro-1-benzofuran-4-yl]ethenyl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl}-2-phenyl-2,3-dihydro-1-benzofuran-3-yl)benzene-1,2,4-triol

ChEBI IDCHEBI:185937
ChEBI Name6-(6-hydroxy-4-{5-[(E)-2-[6-hydroxy-3-(3-hydroxyphenyl)-2-phenyl-2,3-dihydro-1-benzofuran-4-yl]ethenyl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl}-2-phenyl-2,3-dihydro-1-benzofuran-3-yl)benzene-1,2,4-triol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC56H42O10
Net Charge0
Average Mass874.942
Monoisotopic Mass874.27780
SMILESOc1ccc(C2Oc3ccc(/C=C/c4cc(O)cc5c4C(c4cccc(O)c4)C(c4ccccc4)O5)cc3C2c2cc(O)cc3c2C(c2cc(O)cc(O)c2O)C(c2ccccc2)O3)cc1
InChIInChI=1S/C56H42O10/c57-36-19-17-33(18-20-36)55-50(42-25-40(61)29-47-51(42)52(43-26-39(60)27-44(62)53(43)63)56(66-47)32-10-5-2-6-11-32)41-22-30(15-21-45(41)64-55)14-16-35-24-38(59)28-46-48(35)49(34-12-7-13-37(58)23-34)54(65-46)31-8-3-1-4-9-31/h1-29,49-50,52,54-63H/b16-14+
InChIKeyWBWRQEPGUKJRHU-JQIJEIRASA-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-(6-hydroxy-4-{5-[(E)-2-[6-hydroxy-3-(3-hydroxyphenyl)-2-phenyl-2,3-dihydro-1-benzofuran-4-yl]ethenyl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl}-2-phenyl-2,3-dihydro-1-benzofuran-3-yl)benzene-1,2,4-triol (CHEBI:185937) is a benzofurans (CHEBI:35259)
IUPAC Name 
6-[6-hydroxy-4-[5-[(E)-2-[6-hydroxy-3-(3-hydroxyphenyl)-2-phenyl-2,3-dihydro-1-benzouran-4-yl]ethenyl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzouran-3-yl]-2-phenyl-2,3-dihydro-1-benzouran-3-yl]benzene-1,2,4-triol
Manual XrefsDatabases
HMDB0134395HMDB