Acefylline | B3119

Acefylline is a xanthine derivative which acts as potential Peptidylarginine deiminase (PAD) activator. It increases the in vitro deimination of filaggrin by PAD1 and PAD3 at a concentration of 200 μM. It enhances deimination in the stratum corneum which is essential for epidermal photoprotection and moisturizing of the stratum corneum. Acefylline is also a bronchodilator, which inhibits rat lung cAMP phosphodiesterase isoenzymes.

Acefylline is a xanthine derivative which acts as potential Peptidylarginine deiminase (PAD) activator. It increases the in vitro deimination of filaggrin by PAD1 and PAD3 at a concentration of 200 μM. It enhances deimination in the stratum corneum which is essential for epidermal photoprotection and moisturizing of the stratum corneum. Acefylline is also a bronchodilator, which inhibits rat lung cAMP phosphodiesterase isoenzymes.

B3119 | Acefylline DataSheet

Alternate Name/Synonyms: Theophylline-7-acetic acid; 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid; 7-(Carboxymethyl)theophylline; (1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetic acid; 2-(1,3-Dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)acetic acid; 1,3-Dimethylxanthine-7-acetic acid; 2-(1,3-dimethyl-2,6-dioxo-1,3,7-trihydropurin-7-yl)acetic acid

Appearance: White to off-white powder

Formulation:

CAS Number: 652-37-9

Structure Available?: TRUE

Peptide sequence:

Salt Form: FALSE

Molecular Formula: C₉H₁₀N₄O₄

Molecular Weight: 238.2

Cell-Permeable?: True

Purity: ≥ 98%

Solubilities: ~33 mg/ml in DMSO (may need ultrasonication)

Handling: Do not take internally. Wear gloves and mask when handling the product! Avoid contact by all modes of exposure.

Country of Origin: USA

Tag Line: A potential Peptidylarginine deiminase (PAD) activator

MDL Number: MFCD00022832

PubChem CID: 69550

SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O

InChi: InChI=1S/C9H10N4O4/c1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h4H,3H2,1-2H3,(H,14,15)

InChi Key: HCYFGRCYSCXKNQ-UHFFFAOYSA-N