Drug Information

Drug General Information
Drug ID
D08BKE
Former ID
DNC008958
Drug Name
Isosorbide-2-benzylcarbamate-5-triflate
Drug Type
Small molecular drug
Indication Discovery agent Investigative [529716]
Structure
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2D MOL

3D MOL
Formula
C16H16F3NO9S
Canonical SMILES
C1C(C2C(O1)C(CO2)OC(=O)OS(=O)(=O)C(F)(F)F)OC(=O)NCC3=CC<br />=CC=C3
InChI
1S/C16H16F3NO9S/c17-16(18,19)30(23,24)29-15(22)28-11-8-26-12-10(7-25-13(11)12)27-14(21)20-6-9-4-2-1-3-5-9/h1-5,10-13H,6-8H2,(H,20,21)/t10-,11+,12+,13+/m0/s1
InChIKey
WOSIHMSPFKVEAI-UMSGYPCISA-N
PubChem Compound ID
44568822
Target and Pathway
Target(s) Cholinesterase Target Info Inhibitor [529716]
PANTHER Pathway Muscarinic acetylcholine receptor 1 and 3 signaling pathway
Muscarinic acetylcholine receptor 2 and 4 signaling pathway
Nicotinic acetylcholine receptor signaling pathway
WikiPathways Irinotecan Pathway
References
Ref 529716J Med Chem. 2008 Oct 23;51(20):6400-9. Epub 2008 Sep 26.Isosorbide-2-carbamate esters: potent and selective butyrylcholinesterase inhibitors.
Ref 529716J Med Chem. 2008 Oct 23;51(20):6400-9. Epub 2008 Sep 26.Isosorbide-2-carbamate esters: potent and selective butyrylcholinesterase inhibitors.

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