CamA-IN-1

• CAT Number: I042062
• CAS Number: 2924055-46-7
• Molecular Formula: C23H36N6O6
• Molecular Weight: 492.57
• Purity: ≥95%
• Synonyms: tert-butyl 4-[3-[[9-[(2R,3S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]propyl]piperidine-1-carboxylate
• InChI: InChI=1S/C23H36N6O6/c1-23(2,3)35-22(33)28-9-6-14(7-10-28)5-4-8-24-19-16-20(26-12-25-19)29(13-27-16)21-18(32)17(31)15(11-30)34-21/h12-15,17-18,21,30-32H,4-11H2,1-3H3,(H,24,25,26)/t15-,17?,18+,21-/m1/s1
• InChIKey: NYCVBKCHESHFLR-IPZUKPMBSA-N
• SMILES: CC(C)(C)OC(=O)N1CCC(CC1)CCCNC2=C3C(=NC=N2)N(C=N3)C4C(C(C(O4)CO)O)O

CamA-IN-1 is a Clostridioides difficile-specific DNA adenine methyltransferase (CamA) inhibitor. CamA-IN-1 has inhibitory for CamA with IC50 and Kd values of 0.4 μM and 0.2 μM, respectively. CamA-IN-1 can be used for the research of Clostridioides difficile infections (CDI)[1].
CamA-IN-1 (compound 39) has inhibitory for CamA with IC50 and Kd values of 0.4 μM and 0.2 μM, respectively[1].
CamA-IN-1 is selective for CamA over closely related bacterial and mammalian DNA and RNA MTases, protein lysine and arginine MTases, and human adenosine receptors[1].

Reference

[1]. Jujun Zhou, et al. Systematic Design of Adenosine Analogs as Inhibitors of a Clostridioides difficile- Specific DNA Adenine Methyltransferase Required for Normal Sporulation and Persistence. J Med Chem. 2023 Jan 12;66(1):934-950.
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