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CHEBI:185796 - Spinochalcone B

ChEBI IDCHEBI:185796
ChEBI NameSpinochalcone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H26O3
Net Charge0
Average Mass374.480
Monoisotopic Mass374.18819
SMILESCC(C)=CCCC1(C)C=Cc2c(ccc(C(=O)/C=C/c3ccccc3)c2O)O1
InChIInChI=1S/C25H26O3/c1-18(2)8-7-16-25(3)17-15-21-23(28-25)14-12-20(24(21)27)22(26)13-11-19-9-5-4-6-10-19/h4-6,8-15,17,27H,7,16H2,1-3H3/b13-11+
InChIKeyXKBWBVSFQXIHLM-ACCUITESSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Spinochalcone B (CHEBI:185796) is a chalcones (CHEBI:23086)
IUPAC Name 
(E)-1-[5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)chromen-6-yl]-3-phenylprop-2-en-1-one
Manual XrefsDatabases
9756346ChemSpider
LMPK12120015LIPID MAPS