Drug Information

Drug General Information
Drug ID
D0S0SH
Former ID
DNC006889
Drug Name
12-(3-Adamantan-1-yl-ureido)-dodeca noic acid
Drug Type
Small molecular drug
Indication Discovery agent Investigative [530286]
Structure
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2D MOL

3D MOL
Formula
C23H40N2O3
Canonical SMILES
C1C2CC3CC1CC(C2)(C3)NC(=O)NCCCCCCCCCCCC(=O)O
InChI
1S/C23H40N2O3/c26-21(27)10-8-6-4-2-1-3-5-7-9-11-24-22(28)25-23-15-18-12-19(16-23)14-20(13-18)17-23/h18-20H,1-17H2,(H,26,27)(H2,24,25,28)
InChIKey
XLGSEOAVLVTJDH-UHFFFAOYSA-N
PubChem Compound ID
10069117
Target and Pathway
Target(s) Soluble epoxide hydrolase Target Info Inhibitor [530286]
KEGG Pathway Arachidonic acid metabolism
Metabolic pathways
Peroxisome
PathWhiz Pathway Arachidonic Acid Metabolism
WikiPathways Metapathway biotransformation
Arachidonate Epoxygenase / Epoxide Hydrolase
Arachidonic acid metabolism
References
Ref 530286J Med Chem. 2009 Aug 27;52(16):5009-12.Discovery of a highly potent, selective, and bioavailable soluble epoxide hydrolase inhibitor with excellent ex vivo target engagement.
Ref 530286J Med Chem. 2009 Aug 27;52(16):5009-12.Discovery of a highly potent, selective, and bioavailable soluble epoxide hydrolase inhibitor with excellent ex vivo target engagement.

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