Drug General Information
Drug ID
D0T9RD
Former ID
DNC008315
Drug Name
(Z)-2,6-diisopropyl-N-phenyloctadec-9-enamide
Drug Type
Small molecular drug
Indication Discovery agent Investigative [529319]
Structure
Download
2D MOL

3D MOL

Formula
C30H51NO
Canonical SMILES
CCCCCCCCC=CCCC(CCCC(C(C)C)C(=O)NC1=CC=CC=C1)C(C)C
InChI
1S/C30H51NO/c1-6-7-8-9-10-11-12-13-14-16-20-27(25(2)3)21-19-24-29(26(4)5)30(32)31-28-22-17-15-18-23-28/h13-15,17-18,22-23,25-27,29H,6-12,16,19-21,24H2,1-5H3,(H,31,32)/b14-13-
InChIKey
HUQXXTSZFWLRDE-YPKPFQOOSA-N
PubChem Compound ID
Target and Pathway
Target(s) Acetyl-CoA acetyltransferase, mitochondrial Target Info Inhibitor [529319]
BioCyc Pathway Isoleucine degradation
Glutaryl-CoA degradation
Superpathway of geranylgeranyldiphosphate biosynthesis I (via mevalonate)
Superpathway of cholesterol biosynthesis
Mevalonate pathway
Ketogenesis
Ketolysis
KEGG Pathway Fatty acid degradation
Synthesis and degradation of ketone bodies
Valine, leucine and isoleucine degradation
Lysine degradation
Tryptophan metabolism
Pyruvate metabolism
Glyoxylate and dicarboxylate metabolism
Propanoate metabolism
Butanoate metabolism
Terpenoid backbone biosynthesis
Metabolic pathways
Biosynthesis of antibiotics
Carbon metabolism
Fatty acid metabolism
NetPath Pathway Leptin Signaling Pathway
PANTHER Pathway CCKR signaling map ST
PathWhiz Pathway Butyrate Metabolism
Fatty acid Metabolism
Ketone Body Metabolism
Lysine Degradation
Valine, Leucine and Isoleucine Degradation
Pyruvate Metabolism
Propanoate Metabolism
Circadian clock
WikiPathways Tryptophan metabolism
Synthesis and Degradation of Ketone Bodies
Metabolism of amino acids and derivatives
Fatty acid, triacylglycerol, and ketone body metabolism
Fatty Acid Beta Oxidation
References
Ref 529319J Med Chem. 2008 Mar 13;51(5):1474-7. Epub 2008 Feb 20.Biphenyl versus phenylpyridazine derivatives: the role of the heterocycle in a series of acyl-CoA:cholesterol acyl transferase inhibitors.
Ref 529319J Med Chem. 2008 Mar 13;51(5):1474-7. Epub 2008 Feb 20.Biphenyl versus phenylpyridazine derivatives: the role of the heterocycle in a series of acyl-CoA:cholesterol acyl transferase inhibitors.

If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.