cinnamic acid   Click here for help

GtoPdb Ligand ID: 3203

PDB Ligand
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 37.3
Molecular weight 148.05
XLogP 1.91
No. Lipinski's rules broken 0
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Canonical SMILES OC(=O)C=Cc1ccccc1
Isomeric SMILES OC(=O)/C=C/c1ccccc1
InChI InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6+
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]
2. Shama Bhat C, Ramasarma T. (1979)
Inhibition of rat liver mevalonate pyrophosphate decarboxylase and mevalonate phosphate kinase by phenyl and phenolic compounds.
Biochem J, 181 (1): 143-51. [PMID:226078]