para-coumaric acid   

GtoPdb Ligand ID: 5787

Synonyms: hydroxycinnamic acid | p-coumaric acid
Compound class: Synthetic organic
2D Structure
Click here for structure editor
Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 57.53
Molecular weight 164.05
XLogP 1.5
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES OC(=O)C=Cc1ccc(cc1)O
Isomeric SMILES OC(=O)/C=C/c1ccc(cc1)O
InChI InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+
InChI Key NGSWKAQJJWESNS-ZZXKWVIFSA-N
References
1. Ren N, Kaplan R, Hernandez M, Cheng K, Jin L, Taggart AK, Zhu AY, Gan X, Wright SD, Cai TQ. (2009)
Phenolic acids suppress adipocyte lipolysis via activation of the nicotinic acid receptor GPR109A (HM74a/PUMA-G).
J. Lipid Res., 50 (5): 908-14. [PMID:19136666]