Theophylline-d6

• CAS: 117490-39-8
• Catalog Number: ACM117490398
• Category: Inhibitors
• Molecular Weight: 186.20
• Molecular Formula: C₇H₂D₆N₄O₂
• Description: Theophylline-d6 is the deuterium labeled Theophylline. Theophylline is a nonselective phosphodiesterase (PDE) inhibitor, adenosine receptor blocker, and histone deacetylase (HDAC) activator.
• Synonyms: 3,9-Dihydro-1,3-dimethyl-
• IUPAC Name: 1,3-bis(trideuteriomethyl)-7H-purine-2,6-dione
• Canonical SMILES: O=C(N1C([2H])([2H])[2H])N(C([2H])([2H])[2H])C2=C(N=CN2)C1=O
• InChI Key: ZFXYFBGIUFBOJW-WFGJKAKNSA-N
• Appearance: White to Off-White Solid
• Storage: Powder-20°C, 3 years; 4°C, 2 years; In solvent-80°C, 6 months; -20°C, 1 month.
• Exact Mass: 186.10200
• H-Bond Acceptor: 3
• H-Bond Donor: 1
• Shipping: Can be shipped at room temperature, where not in use may vary.