BoNT-IN-1

• CAT Number: I004610
• CAS Number: 694443-03-3
• Molecular Formula: C23H20N4O3
• Molecular Weight: 400.43
• Purity: ≥95%
• Synonyms: 2-methyl-7-[[(4-methylpyridin-2-yl)amino]-(2-nitrophenyl)methyl]quinolin-8-ol
• InChI: InChI=1S/C23H20N4O3/c1-14-11-12-24-20(13-14)26-22(17-5-3-4-6-19(17)27(29)30)18-10-9-16-8-7-15(2)25-21(16)23(18)28/h3-13,22,28H,1-2H3,(H,24,26)
• InChIKey: VXPGAZJVEWWXED-UHFFFAOYSA-N
• SMILES: CC1=CC(=NC=C1)NC(C2=C(C3=C(C=CC(=N3)C)C=C2)O)C4=CC=CC=C4[N+](=O)[O-]

BoNT-IN-1 is a potent inhibitor of Botulinum neurotoxin A light chain (BoNTA LC) with IC50 of 0.9 uM.
IC50 value: 0.9 uM
Target: BoNT
in vitro: BoNT-IN-1 targets BoNT/A LC enzymatic activity,
is highly efficient in vitro, BoNT-IN-1 has good property in cell-based, as well as tissue-based assays.

Reference

[1]. Caglic D, et al. Identification of clinically viable quinolinol inhibitors of botulinum neurotoxin A light chain. J Med Chem. 2014 Feb 13;57(3):669-676.
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