Drug Information

Drug General Information
Drug ID
D09YSV
Former ID
DNC012697
Drug Name
9H-beta-Carboline-3-carboxylic acid butyl ester
Drug Type
Small molecular drug
Indication Discovery agent Investigative [533546]
Structure
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2D MOL

3D MOL
Formula
C16H16N2O2
Canonical SMILES
CCCCOC(=O)C1=NC=C2C(=C1)C3=CC=CC=C3N2
InChI
1S/C16H16N2O2/c1-2-3-8-20-16(19)14-9-12-11-6-4-5-7-13(11)18-15(12)10-17-14/h4-7,9-10,18H,2-3,8H2,1H3
InChIKey
WGNGIELOOKACSB-UHFFFAOYSA-N
PubChem Compound ID
128618
Target and Pathway
Target(s) Gamma-aminobutyric acid receptor subunit alpha-1 Target Info Inhibitor [533546]
Gamma-aminobutyric acid receptor subunit gamma-2 Target Info Inhibitor [533546]
Gamma-aminobutyric acid receptor Target Info Inhibitor [533546]
KEGG Pathway Neuroactive ligand-receptor interaction
Retrograde endocannabinoid signaling
GABAergic synapse
Morphine addiction
Nicotine addictionhsa04080:Neuroactive ligand-receptor interaction
Nicotine addiction
Reactome Ligand-gated ion channel transport
GABA A receptor activationR-HSA-975298:Ligand-gated ion channel transport
GABA A receptor activation
WikiPathways SIDS Susceptibility Pathways
Neurotransmitter Receptor Binding And Downstream Transmission In The Postsynaptic Cell
Iron uptake and transportWP2754:Neurotransmitter Receptor Binding And Downstream Transmission In The Postsynaptic Cell
Iron uptake and transport
References
Ref 533546J Med Chem. 1983 Apr;26(4):499-503.beta-Carbolines as benzodiazepine receptor ligands. 1. Synthesis and benzodiazepine receptor interaction of esters of beta-carboline-3-carboxylic acid.
Ref 533546J Med Chem. 1983 Apr;26(4):499-503.beta-Carbolines as benzodiazepine receptor ligands. 1. Synthesis and benzodiazepine receptor interaction of esters of beta-carboline-3-carboxylic acid.

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