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N-Methyl Naltrexone Sulfate

CAT: 1459-CS-O-38446Size: 1 EachDry Ice: NoHazardous: No
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Description
N-Methyl Naltrexone Sulfate is listed under Metabolite and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Naltrexone. The product is supplied by Clearsynth under CAT No. CS-O-38446. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
1067643-19-9
Synonyms
N-Methyl Naltrexone Sulfate
Molecular Formula
C 21 H 25 NO 7 S
Molecular Weight
435.49
Additionnal Information
N-Methyl Naltrexone Sulfate is supplied with detailed characterization data compliant with regulatory guideline. N-Methyl Naltrexone Sulfate can be used for analytical method development, method validation (AMV), Quality Control (QC) application for Abbreviated New Drug Application (ANDA), or during commercial production of Naltrexone.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

N-Methyl Naltrexone Sulfate
CAS Number1067643-19-9
PubChem CID169444203
IUPAC Name[(4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a-hydroxy-3-methyl-7-oxo-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-9-yl] sulfate
Molecular FormulaC21H25NO7S
Molecular Weight435.5
XLogP0.9
Topological Polar Surface Area121
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Heavy Atom Count30
Formal Charge0
Complexity871
SMILES
C[N+]1(CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)OS(=O)(=O)[O-])O4)O)CC6CC6
InChI
InChI=1S/C21H25NO7S/c1-22(11-12-2-3-12)9-8-20-17-13-4-5-15(29-30(25,26)27)18(17)28-19(20)14(23)6-7-21(20,24)16(22)10-13/h4-5,12,16,19,24H,2-3,6-11H2,1H3/t16-,19+,20+,21-,22?/m1/s1
InChIKey
SFSKDPJZGSPJJC-GAAHOAFPSA-N
Chemical Structure
2D Structure
2D structure of N-Methyl Naltrexone Sulfate
CAS: 1067643-19-9
CID: 169444203
Formula: C21H25NO7S
MW: 435.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight435.5
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Exact Mass435.13517331
Monoisotopic Mass435.13517331
Topological Polar Surface Area121 Ų
Heavy Atom Count30
Formal Charge0
Complexity871
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
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CS-O-06042N, O-Dimethyl naltrexone Iodide
CS-O-03597Naltrexone-d4
CS-T-83047Naltrexone-d3
CS-T-91132Difenzoquat methyl sulfate
CS-O-61182N-Nitroso Naltrexone EP Impurity B
CS-ED-0048210-Hydroxy Naltrexone
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Alternative Products

CatalogName
TRC-M493185-250MGN-Methyl Naltrexone Sulfate
282444-01N-Methyl naltrexone bromide
TRC-M493190-10MGN-Methyl Naltrexone Glucuronide
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TRC-M265395-1MG(S)-N-Methyl Naltrexone Bromide
TRC-I781010-25MGO-Isobutyryl N-Methyl Naltrexone Iodide
TRC-M320353-100MGN-Methyl Naltrexone-O-ethyl Carbonate
TRC-M338360-100MGN-Methyl-O-methylcyclopropyl-Naltrexone Bromide
TRC-M320348-2.5MGN-Methyl 6-Oxo Naltrexone Bromide
TRC-I781012-100MGO-Isobutyryl N-Methyl Naltrexone-d3 Iodide

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