ChemicalBook--->CAS DataBase List--->403848-57-7

403848-57-7

403848-57-7 Structure

403848-57-7 Structure
IdentificationBack Directory
[Name]

AC-LEHD-CMK
[CAS]

403848-57-7
[Synonyms]

AC-LEHD-CMK
AC-LEU-GLU-HIS-ASP-CMK
CASPASE-9 INHIBITOR III
Caspase-9 Inhibitor III(Ac-LEHD-CMK)
AC-LEU-GLU-HIS-ASP-CHLOROMETHYLKETONE
L-Histidinamide, N-acetyl-L-leucyl-L-α-glutamyl-N-[(1S)-1-(carboxymethyl)-3-chloro-2-oxopropyl]-
[Molecular Formula]

C24H35ClN6O9
[MDL Number]

MFCD02259690
[MOL File]

403848-57-7.mol
[Molecular Weight]

587.02
Chemical PropertiesBack Directory
[Boiling point ]

1113.4±65.0 °C(Predicted)
[density ]

1.362±0.06 g/cm3(Predicted)
[storage temp. ]

-15°C
[solubility ]

water: 1 mg/mL || DMSO: 5 mg/mL
[form ]

Powder
[pka]

3.91±0.19(Predicted)
[color ]

White to off-white
[Water Solubility ]

water: 1mg/mL
DMSO: 5mg/mL
[InChIKey]

JSRLQUNMFYXVQD-XSLAGTTESA-N
[SMILES]

ClCC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CC(C)C)CCC(=O)O)Cc1nc[nH]c1)CC(=O)O
Safety DataBack Directory
[WGK Germany ]

WGK 1
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

A potent and irreversible inhibitor of caspase-9
[Biological Activity]

Cell permeable: yes''Primary Target
caspase-9''Product does not compete with ATP.''Reversible: no''Target IC50: 70 nM against caspase-9
[IC 50]

Caspase-9
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