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CHEBI:168167 - 1-O-p-Coumaroyl-beta-D-glucose

ChEBI IDCHEBI:168167
ChEBI Name1-O-p-Coumaroyl-beta-D-glucose
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18O8
Net Charge0
Average Mass326.301
Monoisotopic Mass326.10017
SMILESO=C(/C=C/c1ccc(O)cc1)OC1OC(CO)C(O)C(O)C1O
InChIInChI=1S/C15H18O8/c16-7-10-12(19)13(20)14(21)15(22-10)23-11(18)6-3-8-1-4-9(17)5-2-8/h1-6,10,12-17,19-21H,7H2/b6-3+
InChIKeyDSNCQKUYZOSARM-ZZXKWVIFSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
1-O-p-Coumaroyl-beta-D-glucose (CHEBI:168167) has functional parent hydroxycinnamic acid (CHEBI:24689)
1-O-p-Coumaroyl-beta-D-glucose (CHEBI:168167) is a glycoside (CHEBI:24400)
IUPAC Name 
[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
Manual XrefsDatabases
13512628ChemSpider
HMDB0036936HMDB