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CHEBI:174167 - Dihydrosinapic acid

ChEBI IDCHEBI:174167
ChEBI NameDihydrosinapic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14O5
Net Charge0
Average Mass226.228
Monoisotopic Mass226.08412
SMILESCOc1cc(CCC(=O)O)cc(OC)c1O
InChIInChI=1S/C11H14O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h5-6,14H,3-4H2,1-2H3,(H,12,13)
InChIKeyBPPVOXVSMSXBEI-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Dihydrosinapic acid (CHEBI:174167) is a benzenes (CHEBI:22712)
Dihydrosinapic acid (CHEBI:174167) is a monocarboxylic acid (CHEBI:25384)
IUPAC Name 
3-(4-hydroxy-3,5-dimethoxyphenyl)propanoic acid
Manual XrefsDatabases
76391ChemSpider
HMDB0041727HMDB
Registry NumbersSources
CAS:14897-78-0ChemIDplus