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CHEBI:175166 - 4-(4-Hydroxyphenyl)-2-butanone glucoside

ChEBI IDCHEBI:175166
ChEBI Name4-(4-Hydroxyphenyl)-2-butanone glucoside
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SubmitterMetaboLights
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FormulaC16H22O7
Net Charge0
Average Mass326.345
Monoisotopic Mass326.13655
SMILESCC(=O)CCc1ccc(OC2OC(CO)C(O)C(O)C2O)cc1
InChIInChI=1S/C16H22O7/c1-9(18)2-3-10-4-6-11(7-5-10)22-16-15(21)14(20)13(19)12(8-17)23-16/h4-7,12-17,19-21H,2-3,8H2,1H3
InChIKeyIDONYWHRKBUDOR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(4-Hydroxyphenyl)-2-butanone glucoside (CHEBI:175166) is a glycoside (CHEBI:24400)
IUPAC Name 
4-[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]butan-2-one
Manual XrefsDatabases
15845747ChemSpider
HMDB0034863HMDB