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CHEBI:186346 - Lupinisoflavone G

ChEBI IDCHEBI:186346
ChEBI NameLupinisoflavone G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H26O6
Net Charge0
Average Mass422.477
Monoisotopic Mass422.17294
SMILESCC(C)=CCc1cc(-c2coc3cc4c(c(O)c3c2=O)CC(C(C)(C)O)O4)ccc1O
InChIInChI=1S/C25H26O6/c1-13(2)5-6-15-9-14(7-8-18(15)26)17-12-30-20-11-19-16(23(27)22(20)24(17)28)10-21(31-19)25(3,4)29/h5,7-9,11-12,21,26-27,29H,6,10H2,1-4H3
InChIKeySTWKZOLIYPDQRJ-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)
Lupinisoflavone G (CHEBI:186346) is a isoflavanones (CHEBI:38741)
IUPAC Name 
4-hydroxy-6-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]-2-(2-hydroxypropan-2-yl)-2,3-dihydrouro[3,2-g]chromen-5-one
Manual XrefsDatabases
LMPK12050184LIPID MAPS
24842767ChemSpider