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Tempol-d17,15N

CAT: 0804-HY-100561S-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-100561S-01Size:1 mg
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Description
Tempol-d17,15N is the deuterium labeled Tempol[1]. Tempol is a general superoxide dismutase (SOD) -mimetic agent that efficiently neutralizes reactive oxygen species (ROS) [2][3].
CAS Number
90429-66-6
Product Name Alternative
4-Hydroxy-TEMPO-d17,15N
UNSPSC
12352005
Target
Autophagy; Reactive Oxygen Species (ROS)
Type
Isotope-Labeled Compounds
Related Pathways
Autophagy; Immunology/Inflammation; Metabolic Enzyme/Protease; NF-κB
Applications
Cancer-programmed cell death
Field of Research
Cancer
Purity
98.44
Solubility
10 mM in DMSO
Smiles
[O][15N](C(C([2H])([2H])[2H])(C1([2H])[2H])C([2H])([2H])[2H])C(C([2H])([2H])[2H])(C([2H])([2H])C1([2H])O)C([2H])([2H])[2H]
Molecular Formula
C9HD17 15NO2
Molecular Weight
190.34
References & Citations
[1]Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53 (2) :211-216.|[2]Vilar-Pereira G, et al. Resveratrol Reverses Functional Chagas Heart Disease in Mice. PLoS Pathog. 2016 Oct 27;12 (10) :e1005947.|[3]Chatterjee PK, et al. Tempol, a membrane-permeable radical scavenger, reduces oxidant stress-mediated renal dysfunction and injury in the rat. Kidney Int. 2000 Aug58 (2) :658-73.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported

Chemical Information

4-Hydroxy-2,2,6,6-tetramethylpiperidine-D17-1-15N-1-oxyl
CAS Number90429-66-6
PubChem CID168476662
IUPAC Name3,3,4,5,5-pentadeuterio-1-hydroxy-2,2,6,6-tetrakis(trideuteriomethyl)(115N)azinan-4-ol
Molecular FormulaC9H19NO2
Molecular Weight191.35
XLogP0.9
Topological Polar Surface Area43.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity159
SMILES
[2H]C1(C(C(C([15N](C1(C([2H])([2H])[2H])C([2H])([2H])[2H])O)(C([2H])([2H])[2H])C([2H])([2H])[2H])([2H])[2H])([2H])O)[2H]
InChI
InChI=1S/C9H19NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h7,11-12H,5-6H2,1-4H3/i1D3,2D3,3D3,4D3,5D2,6D2,7D,10+1
InChIKey
CSGAUKGQUCHWDP-BIXFOSJQSA-N
Chemical Structure
2D Structure
2D structure of 4-Hydroxy-2,2,6,6-tetramethylpiperidine-D17-1-15N-1-oxyl
CAS: 90429-66-6
CID: 168476662
Formula: C9H19NO2
MW: 191.35
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight191.35
XLogP30.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass191.245318424
Monoisotopic Mass191.245318424
Topological Polar Surface Area43.7 Ų
Heavy Atom Count12
Formal Charge0
Complexity159
Isotope Atom Count18
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
B2046-STempol