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CHEBI:229996 - 2'-Hydroxy-2,3,5'-trimethoxychalcone

ChEBI IDCHEBI:229996
ChEBI Name2'-Hydroxy-2,3,5'-trimethoxychalcone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H18O5
Net Charge0
Average Mass314.337
Monoisotopic Mass314.11542
SMILESCOc1ccc(O)c(C(=O)/C=C/c2cccc(OC)c2OC)c1
InChIInChI=1S/C18H18O5/c1-21-13-8-10-16(20)14(11-13)15(19)9-7-12-5-4-6-17(22-2)18(12)23-3/h4-11,20H,1-3H3/b9-7+
InChIKeyNRAAGHLLAJEOAZ-VQHVLOKHSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
2'-Hydroxy-2,3,5'-trimethoxychalcone (CHEBI:229996) is a chalcones (CHEBI:23086)
IUPAC Name 
(E)-3-(2,3-dimethoxyphenyl)-1-(2-hydroxy-5-methoxyphenyl)prop-2-en-1-one
Manual XrefsDatabases
4773741ChemSpider