1024168-48-6

Pantothenate kinase-IN-1 Chemical Structure
1024168-48-6

Chemical Structure

Pantothenate kinase-IN-1

  • CAS No.: 1024168-48-6
  • Formula:C21H25N5O
  • Molecular Weight:363.46

IUPAC Name: (1S,5S)-1-hydroxy-1-((2R,2'R,5R,5'R)-5'-((R)-1-hydroxy-13-((S)-5-methyl-2-oxo-2,5-dihydrofuran-3-yl)tridecyl)octahydro-[2,2'-bifuran]-5-yl)undecan-5-yl (tert-butoxycarbonyl)glycyl-L-prolinate

InChIKey: WPAWIBUDSFBBFI-UHFFFAOYSA-N

SMILES: CC(C)(C1=CC=C(C=C1)NC(N2CCN(CC2)C3=NC=C(C=C3)C#N)=O)C

Biological Activity: Pantothenate kinase-IN-1 is a PANK3 inhibitor with an IC50 of 0.51 μM. Pantothenate kinase-IN-1 acts as a pantothenate-competitive inhibitor, which occupies the pantothenate-binding site of PANK3 and binds to both protomers in the PANK3 dimer. Pantothenate kinase-IN-1 exhibits metabolic stability in mouse and rat plasma. Pantothenate kinase-IN-1 can be used in the research of pantothenate kinase-associated neurodegenerative diseases and metabolic diseases[1].

Cat. No. Product Name Purity Description Pricing
HY-144734
Pantothenate kinase-IN-1 98.20% Pantothenate kinase-IN-1 is a PANK3 inhibitor with an IC50 of 0.51 μM. Pantothenate kinase-IN-1 acts as a pantothenate-competitive inhibitor, which occupies the pantothenate-binding site of PANK3 and binds to both protomers in the PANK3 dimer. Pantothenate kinase-IN-1 exhibits metabolic stability in mouse and rat plasma. Pantothenate kinase-IN-1 can be used in the research of pantothenate kinase-associated neurodegenerative diseases and metabolic diseases.
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This compound is listed in the SVHC (Substances of Very High Concern) candidate list of ECHA (European Chemicals Agency).

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References