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CHEBI:183366 - 7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one

ChEBI IDCHEBI:183366
ChEBI Name7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H22O5
Net Charge0
Average Mass330.380
Monoisotopic Mass330.14672
SMILESO=C(CCc1ccc(O)cc1)CC(O)CCc1ccc(O)c(O)c1
InChIInChI=1S/C19H22O5/c20-15-6-1-13(2-7-15)3-8-16(21)12-17(22)9-4-14-5-10-18(23)19(24)11-14/h1-2,5-7,10-11,17,20,22-24H,3-4,8-9,12H2
InChIKeyOAGXTVOZBKKJKA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bombus terrestris (ncbitaxon:30195)
brain (BTO:0000142) MetaboLights (MTBLS3637)
hindgut (BTO:0000510) MetaboLights (MTBLS3637)
hemolymph (BTO:0000572) MetaboLights (MTBLS3637)
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)
7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (CHEBI:183366) is a diarylheptanoid (CHEBI:78802)
IUPAC Name 
7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one
Manual XrefsDatabases
22943315ChemSpider