Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D08LNT
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| Former ID |
DNC003193
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| Drug Name |
Butyrylthiocholine
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| Synonyms |
BUTYRYLTHIOCHOLINE; 4555-00-4; CHEMBL139908; CHEBI:41055; 2-(BUTYRYLSULFANYL)-N,N,N-TRIMETHYLETHANAMINIUM; CHEMBL148530; (Propylcarbonylthioethyl)trimethylammonium iodide; butanoylthiocholine; s-butyrylthiocholine; S-butanoylthiocholine; 2ha7; AC1L2GSR; SCHEMBL570209; Ethanaminium, N,N,N-trimethyl-2-((1-oxobutyl)thio)-; BDBM8978; CTK4I8879; AWBGQVBMGBZGLS-UHFFFAOYSA-; DTXSID00196553; ZINC1592591; MCULE-2436087085; DB04250; 2-butanoylsulfanylethyl(trimethyl)azanium; AN-22197; AJ-27734; CJ-25507
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
 |
Download2D MOL |
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| Formula |
C9H20NOS+
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| Canonical SMILES |
CCCC(=O)SCC[N+](C)(C)C
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| InChI |
1S/C9H20NOS/c1-5-6-9(11)12-8-7-10(2,3)4/h5-8H2,1-4H3/q+1
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| InChIKey |
AWBGQVBMGBZGLS-UHFFFAOYSA-N
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| CAS Number |
CAS 4555-00-4
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| PubChem Compound ID | ||||
| PubChem Substance ID |
829116, 4581098, 6200510, 6441461, 7886092, 8165287, 12076778, 14710543, 15340223, 29288165, 46508351, 53789737, 53812669, 57330703, 77440711, 87691325, 103375017, 104351288, 126410723, 126676339, 127467478, 134339751, 134985405, 137007083, 160967298, 162857196, 163357329, 223510861, 223536905, 223662592, 226876810, 252162385, 252614829
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| ChEBI ID |
CHEBI:41055
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| 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 | DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Nucleic Acids Res. 2011 Jan;39(Database issue):D1035-41. | |||
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