Drug General Information
Drug ID	D08YHD
Former ID	DNC004653
Drug Name	1,1,1-Trifluoro-7-phenylheptan-2-one
Synonyms	1,1,1-Trifluoro-7-phenyl-heptan-2-one
Drug Type	Small molecular drug
Indication	Discovery agent		Investigative	[529843]
Structure		Download 2D MOL 3D MOL
Formula	C13H15F3O
Canonical SMILES	C1=CC=C(C=C1)CCCCCC(=O)C(F)(F)F
InChI	1S/C13H15F3O/c14-13(15,16)12(17)10-6-2-5-9-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2
InChIKey	OYIOJJUJKLHWGM-UHFFFAOYSA-N
PubChem Compound ID	9878121
Target and Pathway
Target(s)	Cytosolic phospholipase A2	Target Info	Inhibitor	[529843]
	Fatty-acid amide hydrolase	Target Info	Inhibitor	[527476]
BioCyc Pathway	PhospholipasesPWY6666-1:Anandamide degradation
KEGG Pathway	Glycerophospholipid metabolism
	Ether lipid metabolism
	Arachidonic acid metabolism
	Linoleic acid metabolism
	alpha-Linolenic acid metabolism
	Metabolic pathways
	MAPK signaling pathway
	Ras signaling pathway
	Vascular smooth muscle contraction
	VEGF signaling pathway
	Platelet activation
	Fc epsilon RI signaling pathway
	Fc gamma R-mediated phagocytosis
	Glutamatergic synapse
	Serotonergic synapse
	Long-term depression
	Inflammatory mediator regulation of TRP channels
	GnRH signaling pathway
	Ovarian steroidogenesis
	Oxytocin signaling pathway
	Choline metabolism in cancerhsa04723:Retrograde endocannabinoid signaling
NetPath Pathway	TCR Signaling Pathway
PANTHER Pathway	Angiogenesis
	Endothelin signaling pathway
	Inflammation mediated by chemokine and cytokine signaling pathway
	Oxidative stress response
	VEGF signaling pathway
	CCKR signaling map STP05728:Anandamide degradation
Pathway Interaction Database	Fc-epsilon receptor I signaling in mast cells
	Endothelins
	PDGFR-beta signaling pathway
	Signaling mediated by p38-alpha and p38-beta
PathWhiz Pathway	Fc Epsilon Receptor I Signaling in Mast Cells
Reactome	Acyl chain remodelling of PC
	Acyl chain remodelling of PE
	Acyl chain remodelling of PI
	ADP signalling through P2Y purinoceptor 1
	Platelet sensitization by LDL
WikiPathways	Prostaglandin Synthesis and Regulation
	p38 MAPK Signaling Pathway
	Glycerophospholipid biosynthesis
	Arachidonic acid metabolism
	PDGF Pathway
	Integrated Pancreatic Cancer Pathway
	AGE/RAGE pathway
	Opioid Signalling
	Signal amplification
	Platelet homeostasis
References
Ref 529843	J Med Chem. 2008 Dec 25;51(24):8027-37.Synthesis of polyfluoro ketones for selective inhibition of human phospholipase A2 enzymes.
Ref 527476	J Med Chem. 2005 Mar 24;48(6):1849-56.Discovery of a potent, selective, and efficacious class of reversible alpha-ketoheterocycle inhibitors of fatty acid amide hydrolase effective as analgesics.
Ref 529843	J Med Chem. 2008 Dec 25;51(24):8027-37.Synthesis of polyfluoro ketones for selective inhibition of human phospholipase A2 enzymes.

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