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CHEBI:185840 - Euchrenone b3

ChEBI IDCHEBI:185840
ChEBI NameEuchrenone b3
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H26O7
Net Charge0
Average Mass462.498
Monoisotopic Mass462.16785
SMILESCOc1cc2c(cc1-c1coc3c4c(c(CC=C(C)C)c(O)c3c1=O)OC(C)(C)C=C4)OCO2
InChIInChI=1S/C27H26O7/c1-14(2)6-7-15-23(28)22-24(29)18(17-10-20-21(33-13-32-20)11-19(17)30-5)12-31-26(22)16-8-9-27(3,4)34-25(15)16/h6,8-12,28H,7,13H2,1-5H3
InChIKeyAOFNFHUUIWLAAW-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)
Euchrenone b3 (CHEBI:185840) is a isoflavanones (CHEBI:38741)
IUPAC Name 
5-hydroxy-3-(6-methoxy-1,3-benzodioxol-5-yl)-8,8-dimethyl-6-(3-methylbut-2-enyl)pyrano[2,3-h]chromen-4-one
Manual XrefsDatabases
LMPK12050325LIPID MAPS
24842833ChemSpider