Theophylline anhydrous, >= 99 %, powder

cas: 58-55-9 — see every product listed under this CAS number, including other names

Theophylline anhydrous, >= 99 %, powder (CAS 58-55-9) is a chemical reagent available from Chemat. Available pack sizes: 100G, 1KG, 250G, 50G. Offered by: Sigma-Aldrich.

brandSigma-Aldrich
catalog numberT1633-100G
cas58-55-9
size100G
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Available pack sizes

brand size price
Sigma-Aldrich 100G 417.00 Pln
Sigma-Aldrich 1KG 1260.00 Pln
Sigma-Aldrich 250G 644.00 Pln
Sigma-Aldrich 50G 260.00 Pln
Structural formula: {0} (CAS {1})

Theophylline is a dimethylxanthine having the two methyl groups located at positions 1 and 3. It is structurally similar to caffeine and is found in green and black tea. It has a role as a bronchodilator agent, a vasodilator agent, a drug metabolite, an anti-asthmatic drug, an EC 3.1.4.* (phosphoric diester hydrolase) inhibitor, an immunomodulator, a muscle relaxant, an anti-inflammatory agent, an adenosine receptor antagonist, a fungal metabolite and a human blood serum metabolite.

Source: ChEBI

Identity
Molecular formulaC7H8N4O2
Molecular weight180.16 g/mol
IUPAC name1,3-dimethyl-7H-purine-2,6-dione
InChIKeyZFXYFBGIUFBOJW-UHFFFAOYSA-N
SMILESCN1C2=C(C(=O)N(C1=O)C)NC=N2

Computed by PubChem (NCBI)

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