Theobromine-d6

Theobromine-d6 is the deuterium labeled Theobromine. Theobromine is a methylxanthine found in cacao beans which can inhibit adenosine receptor A1 (AR1) signaling.

Product Specifications

CAS Number

[117490-40-1]

Product Name Alternative

3,7-Dimethylxanthine-d6

UNSPSC

12352005

Hazard Statement

H302, H315, H319, H335

Target

Adenosine Receptor; Endogenous Metabolite; Isotope-Labeled Compounds

Type

Isotope-Labeled Compounds

Related Pathways

GPCR/G Protein; Metabolic Enzyme/Protease; Others

Field of Research

Neurological Disease

Purity

98.0

Solubility

DMSO : 2.86 mg/mL (ultrasonic; warming; heat to 60°C)

Smiles

O=C(NC1=O)C(N(C=N2)C([2H])([2H])[2H])=C2N1C([2H])([2H])[2H]

Molecular Formula

C7H2D6N4O2

Molecular Weight

186.20

Precautions

H302, H315, H319, H335

References & Citations

[1]Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53 (2) :211-216. |[2]Mitani T, et al. Theobromine suppresses adipogenesis through enhancement of CCAAT-enhancer-binding protein β degradation by adenosine receptor A1.|[3]Martín-Peláez S, et al. Effect of cocoa's theobromine on intestinal microbiota of rats. Mol Nutr Food Res. 2017 Oct;61 (10) .