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CHEBI:187664 - Lespedeol B

ChEBI IDCHEBI:187664
ChEBI NameLespedeol B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H26O6
Net Charge0
Average Mass422.477
Monoisotopic Mass422.17294
SMILESCC(C)=CCCC1(C)C=Cc2c(cc3c(c2O)C(=O)C(c2ccc(O)cc2O)CO3)O1
InChIInChI=1S/C25H26O6/c1-14(2)5-4-9-25(3)10-8-17-20(31-25)12-21-22(23(17)28)24(29)18(13-30-21)16-7-6-15(26)11-19(16)27/h5-8,10-12,18,26-28H,4,9,13H2,1-3H3
InChIKeyCSZKAJDXUNNJKV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Lespedeol B (CHEBI:187664) is a isoflavanones (CHEBI:38741)
IUPAC Name 
7-(2,4-dihydroxyphenyl)-5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-7,8-dihydropyrano[3,2-g]chromen-6-one
Manual XrefsDatabases
LMPK12050496LIPID MAPS
24842927ChemSpider