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CHEBI:186434 - 5-(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-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl)benzene-1,3-diol

ChEBI IDCHEBI:186434
ChEBI Name5-(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-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl)benzene-1,3-diol
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)c2)C(c2ccc(O)cc2)O3)cc1
InChIInChI=1S/C56H42O10/c57-37-16-12-32(13-17-37)55-51(36-24-40(60)26-41(61)25-36)53-45(27-43(63)29-48(53)66-55)52-44-21-30(10-20-46(44)64-56(52)33-14-18-38(58)19-15-33)9-11-35-23-42(62)28-47-49(35)50(34-7-4-8-39(59)22-34)54(65-47)31-5-2-1-3-6-31/h1-29,50-52,54-63H/b11-9+
InChIKeyGXIRUAWQIHWCJJ-PKNBQFBNSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
5-(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-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl)benzene-1,3-diol (CHEBI:186434) is a benzofurans (CHEBI:35259)
IUPAC Name 
5-[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-(4-hydroxyphenyl)-2,3-dihydro-1-benzouran-3-yl]benzene-1,3-diol
Manual XrefsDatabases
HMDB0134220HMDB