Phyto4Health

Cinnamic Acid

Representations & DB's id

ChEBI: CHEBI:35697
ChEMBL: CHEMBL27246
PubChem: 444539
IUPAC: (E)-3-phenylprop-2-enoic acid
Standard InChI: InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6+
Standard InChI Key: WBYWAXJHAXSJNI-VOTSOKGWSA-N
SMILES: OC(=O)/C=C/c1ccccc1

Molecular propeties

AlogP: 1.78
Hydrogen bonds acceptors: 1
Hydrogen bonds donors: 1
Rotatable bonds: 2
Number of rings: 1
Molecular Weight: 148.05
Topological polar surface area: 37.3
Number of aromatic rings: 1
Fsp3: 0
Number of carbons: 9

Plant sources

Part of plant Plant name Ref.
PlantCitrus unshiu
PlantPlantago major
PlantRheum palmatum
PlantGlycyrrhiza uralensis
PlantFoeniculum vulgare
PlantEphedra equisetina

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
IC5068.1 ug/mlAldose reductaseP15121
Ki4900 nMHydroxycarboxylic acid receptor 2Q8TDS4
Others43.6 %Aldose reductaseP15121
Others25.95 %Estrogen receptor alphaP03372
Others12 %Estrogen receptor alphaP03372
IC50100000 nMBeta amyloid A4 proteinP05067