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CHEBI:168860 - 5-{6-hydroxy-2-phenyl-4-[(E)-2-phenylethenyl]-2,3-dihydro-1-benzofuran-3-yl}benzene-1,3-diol

ChEBI IDCHEBI:168860
ChEBI Name5-{6-hydroxy-2-phenyl-4-[(E)-2-phenylethenyl]-2,3-dihydro-1-benzofuran-3-yl}benzene-1,3-diol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H22O4
Net Charge0
Average Mass422.480
Monoisotopic Mass422.15181
SMILESOc1cc(O)cc(C2c3c(/C=C/c4ccccc4)cc(O)cc3OC2c2ccccc2)c1
InChIInChI=1S/C28H22O4/c29-22-14-21(15-23(30)16-22)27-26-20(12-11-18-7-3-1-4-8-18)13-24(31)17-25(26)32-28(27)19-9-5-2-6-10-19/h1-17,27-31H/b12-11+
InChIKeyIENWXRHMPJYJED-VAWYXSNFSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
5-{6-hydroxy-2-phenyl-4-[(E)-2-phenylethenyl]-2,3-dihydro-1-benzofuran-3-yl}benzene-1,3-diol (CHEBI:168860) is a benzofurans (CHEBI:35259)
IUPAC Name 
5-[6-hydroxy-2-phenyl-4-[(E)-2-phenylethenyl]-2,3-dihydro-1-benzouran-3-yl]benzene-1,3-diol
Manual XrefsDatabases
74852468ChemSpider
HMDB0129160HMDB