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biotin-valyl-alanyl-aspartyl-fluoromethyl ketone
A cell permeable inhibitor for caspase proteases.


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03. Biological Effects of Specific Chemicals: biochemical uses [CHEBI:52206] > enzyme inhibitor [CHEBI:23924] > protease inhibitor [CHEBI:37670] > biotin-valyl-alanyl-aspartyl-fluoromethyl ketone [CHEBI:52102]
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03. Biological Effects of Specific Chemicals 
03. Biological Effects of Specific Chemicals
 biochemical uses [CHEBI:52206] (3306) 
 enzyme inhibitor [CHEBI:23924] (825) 
 protease inhibitor [CHEBI:37670] (37) 
 biotin-valyl-alanyl-aspartyl-fluoromethyl ketone [CHEBI:52102] (1)
08. Chemical Category 
08. Chemical Category
 main group molecular entity [CHEBI:33579] (25650) 
 p-block molecular entity [CHEBI:33675] (25343) 
 pnictogen molecular entity [CHEBI:33302] (10027) 
 nitrogen molecular entity [CHEBI:51143] (7930) 
 amide [CHEBI:32988] (1863) 
 primary amide [CHEBI:33256] (1586) 
 carboxamide [CHEBI:37622] (1381) 
 peptide [CHEBI:16670] (730) 
 oligopeptide [CHEBI:7755] (479) 
 tripeptide [CHEBI:47923] (92) 
 biotin-valyl-alanyl-aspartyl-fluoromethyl ketone [CHEBI:52102] (1)
 organonitrogen compound [CHEBI:35352] (6705) 
 carboxamide [CHEBI:37622] (1381) 
 peptide [CHEBI:16670] (730) 
 oligopeptide [CHEBI:7755] (479) 
 tripeptide [CHEBI:47923] (92) 
 biotin-valyl-alanyl-aspartyl-fluoromethyl ketone [CHEBI:52102] (1)
 organic amino compound [CHEBI:50047] (2472) 
 peptide [CHEBI:16670] (730) 
 oligopeptide [CHEBI:7755] (479) 
 tripeptide [CHEBI:47923] (92) 
 biotin-valyl-alanyl-aspartyl-fluoromethyl ketone [CHEBI:52102] (1)
 chalcogen molecular entity [CHEBI:33304] (15225) 
 oxygen molecular entity [CHEBI:25806] (14414) 
 organooxygen compound [CHEBI:36963] (11352) 
 carboxamide [CHEBI:37622] (1381) 
 peptide [CHEBI:16670] (730) 
 oligopeptide [CHEBI:7755] (479) 
 tripeptide [CHEBI:47923] (92) 
 biotin-valyl-alanyl-aspartyl-fluoromethyl ketone [CHEBI:52102] (1)
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 carboxamide [CHEBI:37622] (1381) 
 peptide [CHEBI:16670] (730) 
 oligopeptide [CHEBI:7755] (479) 
 tripeptide [CHEBI:47923] (92) 
 biotin-valyl-alanyl-aspartyl-fluoromethyl ketone [CHEBI:52102] (1)
 carbon group molecular entity [CHEBI:33582] (23847) 
 organic molecular entity [CHEBI:50860] (23769) 
 heteroorganic entity [CHEBI:33285] (15197) 
 organonitrogen compound [CHEBI:35352] (6705) 
 carboxamide [CHEBI:37622] (1381) 
 peptide [CHEBI:16670] (730) 
 oligopeptide [CHEBI:7755] (479) 
 tripeptide [CHEBI:47923] (92) 
 biotin-valyl-alanyl-aspartyl-fluoromethyl ketone [CHEBI:52102] (1)
 organic amino compound [CHEBI:50047] (2472) 
 peptide [CHEBI:16670] (730) 
 oligopeptide [CHEBI:7755] (479) 
 tripeptide [CHEBI:47923] (92) 
 biotin-valyl-alanyl-aspartyl-fluoromethyl ketone [CHEBI:52102] (1)
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 carboxamide [CHEBI:37622] (1381) 
 peptide [CHEBI:16670] (730) 
 oligopeptide [CHEBI:7755] (479) 
 tripeptide [CHEBI:47923] (92) 
 biotin-valyl-alanyl-aspartyl-fluoromethyl ketone [CHEBI:52102] (1)
 organic amino compound [CHEBI:50047] (2472) 
 peptide [CHEBI:16670] (730) 
 oligopeptide [CHEBI:7755] (479) 
 tripeptide [CHEBI:47923] (92) 
 biotin-valyl-alanyl-aspartyl-fluoromethyl ketone [CHEBI:52102] (1)
ChEBI Compound Accession Identifier  [CHEBI:52102]
ChEBI Compound Description  A cell permeable inhibitor for caspase proteases.
ChEBI Compound Identification Number  52102
ChEBI InChI Value  InChI=1S/C23H36FN5O7S/c1-11(2)19(22(35)25-12(3)21(34)26-13(8-18(32)33)15(30)9-24)28-17(31)7-5-4-6-16-20-14(10-37-16)27-23(36)29-20/h11-14,16,19-20H,4-10H2,1-3H3,(H,25,35)(H,26,34)(H,28,31)(H,32,33)(H2,27,29,36)/t12-,13-,14-,16-,19-,20-/m0/s1
ChEBI InChIKey Value  NENCFBUASFVKCT-NYLVQANASA-N
ChEBI Compound Name  biotin-valyl-alanyl-aspartyl-fluoromethyl ketone
ChEBI SMILES Value  [H][C@]12CS[C@@H](CCCCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)CF)[C@@]1([H])NC(=O)N2
ChEBI Substance ID  57304999
ChEBI URL  ChEBI:52102
ChemSpider ID  NS
Ontomatica Chemical Accession Key (OnChAKey)  NENCFBUASFVKCT_NYLVQANASA_N_000_000000
PubChem Compound ID  25195448