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> Main
CHEBI:2417 - acetylcholine chloride
Main
ChEBI Ontology
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ChEBI Name
acetylcholine chloride
ChEBI ID
CHEBI:2417
Definition
The chloride salt of acetylcholine, and a parasympatomimetic drug.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C7H16NO2.Cl
Net Charge
0
Average Mass
181.66000
Monoisotopic Mass
181.08696
InChI
InChI=1S/C7H16NO2.ClH/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1
InChIKey
JUGOREOARAHOCO-UHFFFAOYSA-M
SMILES
[Cl-].CC(=O)OCC[N+](C)(C)C
ChEBI Ontology
Outgoing
acetylcholine chloride (
CHEBI:2417
)
has part
acetylcholine (
CHEBI:15355
)
acetylcholine chloride (
CHEBI:2417
)
is a
quaternary ammonium salt (
CHEBI:35273
)
IUPAC Name
2-acetyloxy-
N
,
N
,
N
-trimethylethanaminium chloride
Synonyms
Sources
(2-Hydroxyethyl)trimethylammonium chloride acetate
ChemIDplus
2-Acetoxyethyltrimethylammonium chloride
ChemIDplus
Acetylcholine chloride
KEGG COMPOUND
Chloroacetylcholine
ChemIDplus
Miochol
ChemIDplus
Manual Xrefs
Databases
C08201
KEGG COMPOUND
D00999
KEGG DRUG
View more database links
Registry Numbers
Types
Sources
3571875
Beilstein Registry Number
Beilstein
60-31-1
CAS Registry Number
KEGG COMPOUND
60-31-1
CAS Registry Number
ChemIDplus
Last Modified
28 July 2014