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CHEBI:186067 - Brosimacutin I

ChEBI IDCHEBI:186067
ChEBI NameBrosimacutin I
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24O6
Net Charge0
Average Mass360.406
Monoisotopic Mass360.15729
SMILESCC(C)(O)C(O)Cc1c(O)ccc(CCC(=O)c2ccc(O)cc2)c1O
InChIInChI=1S/C20H24O6/c1-20(2,26)18(24)11-15-17(23)10-6-13(19(15)25)5-9-16(22)12-3-7-14(21)8-4-12/h3-4,6-8,10,18,21,23-26H,5,9,11H2,1-2H3
InChIKeyGWBOCBSRSSJWFR-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)
Brosimacutin I (CHEBI:186067) is a dihydrochalcones (CHEBI:71230)
IUPAC Name 
3-[3-(2,3-dihydroxy-3-methylbutyl)-2,4-dihydroxyphenyl]-1-(4-hydroxyphenyl)propan-1-one
Manual XrefsDatabases
LMPK12120599LIPID MAPS
9123613ChemSpider