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Methscopolamine

CAT: 1568-C16569-02Size: 200 mgDry Ice: YesHazardous: No
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CAT#:1568-C16569-02Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
155-41-9
SKU
C16569-200mg
Target
AChR
Applications
Neuronal Signaling
Smiles
C[N+]1 (C2CC (CC1C3C2O3) OC (=O) C (CO) C4=CC=CC=C4) C.[Br-]
Molecular Formula
C18H24BrNO4
Additionnal Information
Methscopolamine is a muscarinic acetylcholine receptor blocker.
Storage Conditions
2 years -80 in solvent

Chemical Information

Methscopolamine bromide

Scopolamine methobromide is a quaternary ammonium salt resulting from the reaction of the amino group of scopolamine with methyl bromide. It has a role as a muscarinic antagonist, a parasympatholytic, an antiemetic and an antispasmodic drug. It is a bromide salt and a quaternary ammonium salt. It is functionally related to a scopolamine.

CAS Number155-41-9
PubChem CID5459110
IUPAC Name[(1R,2R,4S,5S)-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl] (2S)-3-hydroxy-2-phenylpropanoate bromide
Molecular FormulaC18H24BrNO4
Molecular Weight398.3
Topological Polar Surface Area59.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count24
Formal Charge0
Complexity454
SMILES
C[N+]1([C@@H]2CC(C[C@H]1[C@H]3[C@@H]2O3)OC(=O)[C@H](CO)C4=CC=CC=C4)C.[Br-]
InChI
InChI=1S/C18H24NO4.BrH/c1-19(2)14-8-12(9-15(19)17-16(14)23-17)22-18(21)13(10-20)11-6-4-3-5-7-11;/h3-7,12-17,20H,8-10H2,1-2H3;1H/q+1;/p-1/t12?,13-,14-,15+,16-,17+;/m1./s1
InChIKey
CXYRUNPLKGGUJF-OZVSTBQFSA-M
Chemical Structure
2D Structure
2D structure of Methscopolamine bromide
CAS: 155-41-9
CID: 5459110
Formula: C18H24BrNO4
MW: 398.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight398.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass397.08887
Monoisotopic Mass397.08887
Topological Polar Surface Area59.1 Ų
Heavy Atom Count24
Formal Charge0
Complexity454
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS3602209-01Methscopolamine
284918-01Methscopolamine bromide
HY-B0344-01Methscopolamine (bromide)
A10579-250Methscopolamine bromide 250mg
A10579-25Methscopolamine bromide 25mg
M3360Methscopolamine-d3 Iodide
A10579-100Methscopolamine bromide 100mg
A10579-500Methscopolamine bromide 500mg
A10579-50Methscopolamine bromide 50mg

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