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CHEBI:189045 - 1-(4-hydroxy-3-methoxyphenyl)-7-(3-hydroxyphenyl)heptane-3,5-dione

ChEBI IDCHEBI:189045
ChEBI Name1-(4-hydroxy-3-methoxyphenyl)-7-(3-hydroxyphenyl)heptane-3,5-dione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22O5
Net Charge0
Average Mass342.391
Monoisotopic Mass342.14672
SMILESCOc1cc(CCC(=O)CC(=O)CCc2cccc(O)c2)ccc1O
InChIInChI=1S/C20H22O5/c1-25-20-12-15(7-10-19(20)24)6-9-18(23)13-17(22)8-5-14-3-2-4-16(21)11-14/h2-4,7,10-12,21,24H,5-6,8-9,13H2,1H3
InChIKeyLALFLVYIAIOVIR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Anopheles sinensis (ncbitaxon:74873) Whole Organism (NCIT:C13413) Article
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)
1-(4-hydroxy-3-methoxyphenyl)-7-(3-hydroxyphenyl)heptane-3,5-dione (CHEBI:189045) is a diarylheptanoid (CHEBI:78802)
IUPAC Name 
1-(4-hydroxy-3-methoxyphenyl)-7-(3-hydroxyphenyl)heptane-3,5-dione
Manual XrefsDatabases
74853339ChemSpider
HMDB0133499HMDB