Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
D0N1CK
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| Former ID |
DNC004654
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| Drug Name |
1,1,1-Trifluoro-8-phenyl-octan-2-one
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| Synonyms |
1,1,1-Trifluoro-8-phenyloctan-2-one
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| Indication | Discovery agent | Investigative | [529843] | ||
| Canonical SMILES |
C1=CC=C(C=C1)CCCCCCC(=O)C(F)(F)F
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| InChI |
1S/C14H17F3O/c15-14(16,17)13(18)11-7-2-1-4-8-12-9-5-3-6-10-12/h3,5-6,9-10H,1-2,4,7-8,11H2
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| InChIKey |
LKXJGCHERZYPOU-UHFFFAOYSA-N
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| 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 | ||||
| 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 | ||||
| References | |||||
| 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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