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Selegiline hydrochloride

CAT: 0013-GTR19277437-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19277437-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Selegiline hydrochloride is a selective, reversible inhibitor of MAO-B (Ki = 0.091 μM) over MAO-A (Ki = 9.06 μM) . Monoamine oxidase (MAO) inhibitors have utility in ameliorating a variety of neurological conditions, including depression.
CAS Number
14611-52-0
Purity
99.34% (May vary between batches)
Smiles
Cl.C[C@@H] (Cc1ccccc1) N (C) CC#C
Molecular Formula
C13H18ClN
Molecular Weight
223.74
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Selegiline Hydrochloride

Selegiline Hydrochloride is the hydrochloride salt form of selegiline, a levorotatory acetylenic derivative of phenethylamine with antiparkinsonian effect. As a selective monoamine oxidase (MAO) inhibitor, selegiline has the greatest affinity for type B MAO, found mainly in the brain. Selegiline is converted by MAO B to an active moiety, which binds irreversibly at the active site of the enzyme's cofactor FAD (flavin adenine dinucleotide) molecule. This prevents the oxidative deamination of catecholamines and serotonin by MAO B, and leads to an increase in these neurotransmitters' activities resulting in improved motor function. In addition, this agent may inhibit re-uptake of dopamine by the neuron and prolong dopamine activity.

CAS Number14611-52-0
PubChem CID26758
IUPAC Name(2R)-N-methyl-1-phenyl-N-prop-2-ynylpropan-2-amine;hydrochloride
Molecular FormulaC13H18ClN
Molecular Weight223.74
Topological Polar Surface Area3.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Heavy Atom Count15
Formal Charge0
Complexity195
SMILES
C[C@H](CC1=CC=CC=C1)N(C)CC#C.Cl
InChI
InChI=1S/C13H17N.ClH/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13;/h1,5-9,12H,10-11H2,2-3H3;1H/t12-;/m1./s1
InChIKey
IYETZZCWLLUHIJ-UTONKHPSSA-N
Chemical Structure
2D Structure
2D structure of Selegiline Hydrochloride
CAS: 14611-52-0
CID: 26758
Formula: C13H18ClN
MW: 223.74
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight223.74
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass223.1127773
Monoisotopic Mass223.1127773
Topological Polar Surface Area3.2 Ų
Heavy Atom Count15
Formal Charge0
Complexity195
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
HY-14199-01Selegiline (hydrochloride)
M19873-01Selegiline hydrochloride
AR-S09370-01(RS) -Selegiline hydrochloride
CS-O-06957Selegiline-d5 Hydrochloride
HY-14199SSelegiline-d5 (hydrochloride)
RM-S050701-01Selegiline Hydrochloride EP Impurity A
RM-S050714-01Selegiline Hydrochloride Impurity 14
HY-144162S-01(Rac) -Selegiline-d5 (hydrochloride)
RM-S050713-01Selegiline Hydrochloride Impurity 13
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