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Details

Stereochemistry ACHIRAL
Molecular Formula C36H62N4O2.4ClH
Molecular Weight 728.747
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHOCTRAMINE

SMILES

Cl.Cl.Cl.Cl.COC1=CC=CC=C1CNCCCCCCNCCCCCCCCNCCCCCCNCC2=C(OC)C=CC=C2

InChI

InChIKey=CDKGGOUDHGSFAF-UHFFFAOYSA-N
InChI=1S/C36H62N4O2.4ClH/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;4*1H

HIDE SMILES / InChI

Molecular Formula C36H62N4O2
Molecular Weight 582.9031
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Constitutive activity and inverse agonism at the M2 muscarinic acetylcholine receptor.
2006 Jan
Muscarinic acetylcholine receptor-dependent induction of persistent synaptic enhancement in rat hippocampus in vivo.
2007 Jan 19
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:21:35 GMT 2023
Edited
by admin
on Sat Dec 16 08:21:35 GMT 2023
Record UNII
RLO2T99XT3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHOCTRAMINE
Common Name English
METHOCTRAMINE HYDROCHLORIDE
Common Name English
1,8-OCTANEDIAMINE, N,N'-BIS(6-(((2-METHOXYPHENYL)METHYL)AMINO)HEXYL)-, TETRAHYDROCHLORIDE
Systematic Name English
Code System Code Type Description
FDA UNII
RLO2T99XT3
Created by admin on Sat Dec 16 08:21:35 GMT 2023 , Edited by admin on Sat Dec 16 08:21:35 GMT 2023
PRIMARY
WIKIPEDIA
Methoctramine
Created by admin on Sat Dec 16 08:21:35 GMT 2023 , Edited by admin on Sat Dec 16 08:21:35 GMT 2023
PRIMARY
PUBCHEM
107759
Created by admin on Sat Dec 16 08:21:35 GMT 2023 , Edited by admin on Sat Dec 16 08:21:35 GMT 2023
PRIMARY
CHEBI
73452
Created by admin on Sat Dec 16 08:21:35 GMT 2023 , Edited by admin on Sat Dec 16 08:21:35 GMT 2023
PRIMARY
CAS
104807-46-7
Created by admin on Sat Dec 16 08:21:35 GMT 2023 , Edited by admin on Sat Dec 16 08:21:35 GMT 2023
PRIMARY
EPA CompTox
DTXSID40146754
Created by admin on Sat Dec 16 08:21:35 GMT 2023 , Edited by admin on Sat Dec 16 08:21:35 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Binding Assay
IC50
TARGET -> INHIBITOR
methoctramine is a selective muscarinic M2 receptor antagonist
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY