CHEBI:73339 - methoctramine

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ChEBI Name methoctramine
ChEBI ID CHEBI:73339
Definition A tetramine that is N,N'-bis(6-aminohexyl)octane-1,8-diamine where the primary amino groups both carry 2-methoxybenzyl substituents.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Margaret Duesbury
Supplier Information
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Formula C36H62N4O2
Net Charge 0
Average Mass 582.90310
Monoisotopic Mass 582.48728
InChI InChI=1S/C36H62N4O2/c1-41-35-23-13-11-21-33(35)31-39-29-19-9-7-17-27-37-25-15-5-3-4-6-16-26-38-28-18-8-10-20-30-40-32-34-22-12-14-24-36(34)42-2/h11-14,21-24,37-40H,3-10,15-20,25-32H2,1-2H3
InChIKey RPMBYDYUVKEZJA-UHFFFAOYSA-N
SMILES COc1ccccc1CNCCCCCCNCCCCCCCCNCCCCCCNCc1ccccc1OC
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): muscarinic antagonist
A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.
Application(s): muscarinic antagonist
A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing methoctramine (CHEBI:73339) has role muscarinic antagonist (CHEBI:48876)
methoctramine (CHEBI:73339) is a aromatic ether (CHEBI:35618)
methoctramine (CHEBI:73339) is a tetramine (CHEBI:39166)
methoctramine (CHEBI:73339) is conjugate base of methoctramine(4+) (CHEBI:73453)
Incoming methoctramine(4+) (CHEBI:73453) is conjugate acid of methoctramine (CHEBI:73339)
IUPAC Name
N,N'-bis{6-[(2-methoxybenzyl)amino]hexyl}octane-1,8-diamine
Registry Number Type Source
4772600 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
23597562 PubMed citation Europe PMC
Last Modified
01 May 2013