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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
Antagonist binding properties of five cloned muscarinic receptors expressed in CHO-K1 cells.
1989 Apr
Antagonist binding profiles of five cloned human muscarinic receptor subtypes.
1991 Feb
Stimulation of cyclic AMP accumulation and phosphoinositide hydrolysis by M3 muscarinic receptors in the rat peripheral lung.
1996 Aug 23
Pharmacological comparison of the cloned human and rat M2 muscarinic receptor genes expressed in the murine fibroblast (B82) cell line.
1998 Feb
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