Name: (Z-LL)2 ketone
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HIT ID:HIT218639221
Cas No:313664-40-3
Common Name:(Z-LL)2 ketone
IUPAC:benzyl N-[(1S)-1-{[(1S)-1-({3-[(2S)-2-[(2S)-2-{[(benzyloxy)carbonyl]amino}-4-methylpentanamido]-4-methylpentanamido]-2-oxopropyl}carbamoyl)-3-methylbutyl]carbamoyl}-3-methylbutyl]carbamate
IUPAC:benzyl N-[(1S)-1-{[(1S)-1-({3-[(2S)-2-[(2S)-2-{[(benzyloxy)carbonyl]amino}-4-methylpentanamido]-4-methylpentanamido]-2-oxopropyl}carbamoyl)-3-methylbutyl]carbamoyl}-3-methylbutyl]carbamate
InChI key:JTVCWQUNPMKMER-BQYLNSIHSA-N

Molecular Formula:C43H64N6O9
Molecular Weight:809.018
Hydrogen Bond Donor (HBD):
Hydrogen Bond Acceptor (HBA):
LogP:
SMILES:CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1
SMILES:CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1

(Z-LL)2 ketone, an inhibitor of ketone with an IC50 value of 50 nM, facilitates the release of N-terminal fragments into the cytoplasm.

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