Drug Information

Drug General Information
Drug ID
D07BJC
Former ID
DNC009786
Drug Name
13-n-Heptanamidotridec-5-ynoic acid
Drug Type
Small molecular drug
Indication Discovery agent Investigative [530294]
Structure
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2D MOL

3D MOL
Formula
C20H35NO3
Canonical SMILES
CCCCCCC(=O)NCCCCCCCC#CCCCC(=O)O
InChI
1S/C20H35NO3/c1-2-3-4-13-16-19(22)21-18-15-12-10-8-6-5-7-9-11-14-17-20(23)24/h2-6,8,10-18H2,1H3,(H,21,22)(H,23,24)
InChIKey
UGVCHIUURWYSNO-UHFFFAOYSA-N
PubChem Compound ID
44235174
Target and Pathway
Target(s) Soluble epoxide hydrolase Target Info Inhibitor [530294]
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 530294J Med Chem. 2009 Aug 27;52(16):5069-75.14,15-Epoxyeicosa-5,8,11-trienoic acid (14,15-EET) surrogates containing epoxide bioisosteres: influence upon vascular relaxation and soluble epoxide hydrolase inhibition.
Ref 530294J Med Chem. 2009 Aug 27;52(16):5069-75.14,15-Epoxyeicosa-5,8,11-trienoic acid (14,15-EET) surrogates containing epoxide bioisosteres: influence upon vascular relaxation and soluble epoxide hydrolase inhibition.

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