EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:175000 - 5-Methoxy-7-(4-hydroxyphenyl)-1-phenyl-3-heptanone

ChEBI IDCHEBI:175000
ChEBI Name5-Methoxy-7-(4-hydroxyphenyl)-1-phenyl-3-heptanone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24O3
Net Charge0
Average Mass312.409
Monoisotopic Mass312.17254
SMILESCOC(CCc1ccc(O)cc1)CC(=O)CCc1ccccc1
InChIInChI=1S/C20H24O3/c1-23-20(14-10-17-7-11-18(21)12-8-17)15-19(22)13-9-16-5-3-2-4-6-16/h2-8,11-12,20-21H,9-10,13-15H2,1H3
InChIKeyXXVCRBHITJEJAY-UHFFFAOYSA-N
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
5-Methoxy-7-(4-hydroxyphenyl)-1-phenyl-3-heptanone (CHEBI:175000) is a diarylheptanoid (CHEBI:78802)
IUPAC Name 
7-(4-hydroxyphenyl)-5-methoxy-1-phenylheptan-3-one
Manual XrefsDatabases
HMDB0033294HMDB
4477748ChemSpider