CHEBI:2627 - ambenonium

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ChEBI Name ambenonium
ChEBI ID CHEBI:2627
Definition A symmetrical oxalamide-based bis-quaternary ammonium ion having ethyl and 2-chlorobenzyl groups attached to the nitrogens.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C28H42Cl2N4O2
Net Charge +2
Average Mass 537.56500
Monoisotopic Mass 536.26738
InChI InChI=1S/C28H40Cl2N4O2/c1-5-33(6-2,21-23-13-9-11-15-25(23)29)19-17-31-27(35)28(36)32-18-20-34(7-3,8-4)22-24-14-10-12-16-26(24)30/h9-16H,5-8,17-22H2,1-4H3/p+2
InChIKey OMHBPUNFVFNHJK-UHFFFAOYSA-P
SMILES CC[N+](CC)(CCNC(=O)C(=O)NCC[N+](CC)(CC)Cc1ccccc1Cl)Cc1ccccc1Cl
Roles Classification
Biological Role(s): EC 3.1.1.8 (cholinesterase) inhibitor
An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of cholinesterase (EC 3.1.1.8).
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ChEBI Ontology
Outgoing ambenonium (CHEBI:2627) has role EC 3.1.1.8 (cholinesterase) inhibitor (CHEBI:37733)
ambenonium (CHEBI:2627) is a quaternary ammonium ion (CHEBI:35267)
IUPAC Name
2,2'-[(1,2-dioxoethane-1,2-diyl)diimino]bis[N-(2-chlorobenzyl)-N,N-diethylethanaminium]
Synonyms Sources
Ambenonium KEGG COMPOUND
Ambenonium Base ChemIDplus
Ambenonum ChemIDplus
Manual Xrefs Databases
146 DrugCentral
Ambenonium Wikipedia
C07773 KEGG COMPOUND
DB01122 DrugBank
View more database links
Registry Numbers Types Sources
4168740 Beilstein Registry Number Beilstein
7648-98-8 CAS Registry Number ChemIDplus
Last Modified
22 February 2017