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CHEBI:185730 - Quercetol B

ChEBI IDCHEBI:185730
ChEBI NameQuercetol B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H28O4
Net Charge0
Average Mass368.473
Monoisotopic Mass368.19876
SMILESCOc1cc(OC)c2c(c1CC=C(C)C)O[C@H](c1ccccc1)C[C@H]2OC
InChIInChI=1S/C23H28O4/c1-15(2)11-12-17-19(24-3)14-21(26-5)22-20(25-4)13-18(27-23(17)22)16-9-7-6-8-10-16/h6-11,14,18,20H,12-13H2,1-5H3/t18-,20+/m0/s1
InChIKeyQYAYIWOQUZDATC-AZUAARDMSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Quercetol B (CHEBI:185730) is a flavans (CHEBI:38672)
IUPAC Name 
(2S,4R)-4,5,7-trimethoxy-8-(3-methylbut-2-enyl)-2-phenyl-3,4-dihydro-2H-chromene
Manual XrefsDatabases
LMPK12020161LIPID MAPS
24842588ChemSpider