1461648-55-4

PDI-IN-1 Chemical Structure
1461648-55-4

Chemical Structure

PDI-IN-1

  • CAS No.: 1461648-55-4
  • Formula:C30H37N3O7S
  • Molecular Weight:583.70

IUPAC Name: 4-((S)-2-((S)-2-((tert-butoxycarbonyl)amino)-3-phenylpropanamido)-3-oxo-3-(pent-4-yn-1-ylamino)propyl)phenyl ethenesulfonate

InChIKey: RNMDSOKRNOMQFX-UIOOFZCWSA-N

SMILES: O=C([C@@H](NC([C@@H](NC(OC(C)(C)C)=O)CC1=CC=CC=C1)=O)CC2=CC=C(C=C2)OS(=O)(C=C)=O)NCCCC#C

Biological Activity: PDI-IN-1 is a cell-permeable PDI covalent inhibitor with an IC50 of 1.7 μM against bovine PDI. PDI-IN-1 specifically modifies the Cys397 residue at the active site of human PDI, selectively labels endogenous PDI in living mammalian cancer cells, and effectively inhibits PDI-mediated insulin aggregation in vitro. PDI-IN-1 exhibits significant anti-tumor activity and inhibits the growth of various cancer cell lines[1].

Cat. No. Product Name Purity Description Pricing
HY-110172
PDI-IN-1 99.92% PDI-IN-1 is a cell-permeable PDI covalent inhibitor with an IC50 of 1.7 μM against bovine PDI. PDI-IN-1 specifically modifies the Cys397 residue at the active site of human PDI, selectively labels endogenous PDI in living mammalian cancer cells, and effectively inhibits PDI-mediated insulin aggregation in vitro. PDI-IN-1 exhibits significant anti-tumor activity and inhibits the growth of various cancer cell lines.
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This product is a controlled substance and not for sale in your territory.

This product is not for sale in your territory.

This compound is listed in the SVHC (Substances of Very High Concern) candidate list of ECHA (European Chemicals Agency).

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References