Drug Information

Drug General Information
Drug ID
D0H5XD
Former ID
DNC012084
Drug Name
3-(3-Carboxy-propionylamino)-benzoic acid
Drug Type
Small molecular drug
Indication Discovery agent Investigative [526619]
Structure
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2D MOL

3D MOL
Formula
C11H11NO5
Canonical SMILES
C1=CC(=CC(=C1)NC(=O)CCC(=O)O)C(=O)O
InChI
1S/C11H11NO5/c13-9(4-5-10(14)15)12-8-3-1-2-7(6-8)11(16)17/h1-3,6H,4-5H2,(H,12,13)(H,14,15)(H,16,17)
InChIKey
IKRKGFIXYILHIJ-UHFFFAOYSA-N
PubChem Compound ID
757562
Target and Pathway
Target(s) Acetylcholinesterase Target Info Inhibitor [526619]
KEGG Pathway Glycerophospholipid metabolism
Cholinergic synapse
PANTHER Pathway Muscarinic acetylcholine receptor 1 and 3 signaling pathway
Muscarinic acetylcholine receptor 2 and 4 signaling pathway
Nicotinic acetylcholine receptor signaling pathway
Pathway Interaction Database ATF-2 transcription factor network
PathWhiz Pathway Phospholipid Biosynthesis
WikiPathways Monoamine Transport
Biogenic Amine Synthesis
Acetylcholine Synthesis
Integrated Pancreatic Cancer Pathway
References
Ref 526619Bioorg Med Chem Lett. 2003 May 19;13(10):1825-7.Synthesis, anticholinesterase activity and structure-activity relationships of m-Aminobenzoic acid derivatives.
Ref 526619Bioorg Med Chem Lett. 2003 May 19;13(10):1825-7.Synthesis, anticholinesterase activity and structure-activity relationships of m-Aminobenzoic acid derivatives.

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