Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D08BKE
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| Former ID |
DNC008958
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| Drug Name |
Isosorbide-2-benzylcarbamate-5-triflate
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| Synonyms |
CHEMBL492636; Isosorbide-2-benzylcarbamate-5-triflate
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C16H16F3NO9S
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| Canonical SMILES |
C1C(C2C(O1)C(CO2)OC(=O)OS(=O)(=O)C(F)(F)F)OC(=O)NCC3=CC=CC=C3
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| 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
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| InChIKey |
WOSIHMSPFKVEAI-UMSGYPCISA-N
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| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Cholinesterase (BCHE) | Target Info | Inhibitor | [1] |
| 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 | Top | |||
|---|---|---|---|---|
| REF 1 | Isosorbide-2-carbamate esters: potent and selective butyrylcholinesterase inhibitors. J Med Chem. 2008 Oct 23;51(20):6400-9. | |||
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