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CHEBI:187002 - Tephrinone

ChEBI IDCHEBI:187002
ChEBI NameTephrinone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22O4
Net Charge0
Average Mass338.403
Monoisotopic Mass338.15181
SMILESCOc1cc(O)c2c(c1CC=C(C)C)OC(c1ccccc1)CC2=O
InChIInChI=1S/C21H22O4/c1-13(2)9-10-15-19(24-3)12-17(23)20-16(22)11-18(25-21(15)20)14-7-5-4-6-8-14/h4-9,12,18,23H,10-11H2,1-3H3
InChIKeyNISHDQWTPMJBJI-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)
Tephrinone (CHEBI:187002) is a flavanones (CHEBI:28863)
IUPAC Name 
5-hydroxy-7-methoxy-8-(3-methylbut-2-enyl)-2-phenyl-2,3-dihydrochromen-4-one
Manual XrefsDatabases
LMPK12140171LIPID MAPS
137871ChemSpider
Registry NumbersSources
CAS:75291-75-7ChemIDplus