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CHEBI:185790 - {4-[(E)-2-{3,5-dihydroxy-4-[(1E)-3-methylbut-1-en-1-yl]phenyl}ethenyl]phenyl}oxidanesulfonic acid

ChEBI IDCHEBI:185790
ChEBI Name{4-[(E)-2-{3,5-dihydroxy-4-[(1E)-3-methylbut-1-en-1-yl]phenyl}ethenyl]phenyl}oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H20O6S
Net Charge0
Average Mass376.430
Monoisotopic Mass376.09806
SMILESCC(C)/C=C/c1c(O)cc(/C=C/c2ccc(OS(=O)(=O)O)cc2)cc1O
InChIInChI=1S/C19H20O6S/c1-13(2)3-10-17-18(20)11-15(12-19(17)21)5-4-14-6-8-16(9-7-14)25-26(22,23)24/h3-13,20-21H,1-2H3,(H,22,23,24)/b5-4+,10-3+
InChIKeyOWDOCEVISDWNDN-RUQOPNIZSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
{4-[(E)-2-{3,5-dihydroxy-4-[(1E)-3-methylbut-1-en-1-yl]phenyl}ethenyl]phenyl}oxidanesulfonic acid (CHEBI:185790) is a stilbenoid (CHEBI:26776)
IUPAC Name 
[4-[(E)-2-[3,5-dihydroxy-4-[(E)-3-methylbut-1-enyl]phenyl]ethenyl]phenyl] hydrogen sulate
Manual XrefsDatabases
74852415ChemSpider
HMDB0128996HMDB