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CHEBI:193343 - 3-[4-hydroxy-3-(4-hydroxy-3-methylbut-2-en-1-yl)phenyl]prop-2-enoic acid

ChEBI IDCHEBI:193343
ChEBI Name3-[4-hydroxy-3-(4-hydroxy-3-methylbut-2-en-1-yl)phenyl]prop-2-enoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H16O4
Net Charge0
Average Mass248.278
Monoisotopic Mass248.10486
SMILESCC(=CCc1cc(C=CC(=O)O)ccc1O)CO
InChIInChI=1S/C14H16O4/c1-10(9-15)2-5-12-8-11(3-6-13(12)16)4-7-14(17)18/h2-4,6-8,15-16H,5,9H2,1H3,(H,17,18)
InChIKeyWIONBNBDOOYIGS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-[4-hydroxy-3-(4-hydroxy-3-methylbut-2-en-1-yl)phenyl]prop-2-enoic acid (CHEBI:193343) is a hydroxycinnamic acid (CHEBI:24689)
IUPAC Name 
3-[4-hydroxy-3-(4-hydroxy-3-methylbut-2-enyl)phenyl]prop-2-enoic acid