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HCID 439487Erstellt: 26. Oktober 2026

3-(((1-(((4-((Aminoiminomethyl)-amino)butyl)amino)carbonyl)-3-methylbutyl)amino)carbonyl)oxiran-carbonsäure, (2S-(2 alpha, 3 beta(R*)))

E-64 · L-TRANS-EPOXYSUCCINYL-LEU-4-GUANIDINOBUTYLAMIDE · TRANS-EPOXYSUCCINYL-L-LEUCYLAMIDO-(4-GUANIDINO)BUTANE · E-64 HEMIHYDRATE · E-64 PROTEASE INHIBITOR · e64(proteinaseinhibitor) · E-64, cysteine protease inhibitor · L-TRANS-3-CARBOXYOXIRAN-2-CARBONYL-L-LEUCYLAGMATINE

https://huagongshe.com/de/chemical/439487

Molekülstruktur von 3-(((1-(((4-((Aminoiminomethyl)-amino)butyl)amino)carbonyl)-3-methylbutyl)amino)carbonyl)oxiran-carbonsäure, (2S-(2 alpha, 3 beta(R*)))

Identifikatoren & physikalische Daten

CAS No.66701-25-5
SummenformelC15H27N5O5
Durchschnittliche Molmasse357,41 g/mol
Monoisotopische Masse357,20121896 g/mol
SMILESCC(C)C[C@H](NC(=O)[C@@H]1O[C@H]1C(=O)O)C(=O)NCCCCN=C(N)N
InChIKeyLTLYEAJONXGNFG-HBNTYKKESA-N
PubChem CID439487
ChEMBLCHEMBL1458713
EC No.613-978-4
DTXSIDDTXSID90985271
Lokaler Name3-(((1-(((4-((Aminoiminomethyl)-amino)butyl)amino)carbonyl)-3-methylbutyl)amino)carbonyl)oxiran-carbonsäure, (2S-(2 alpha, 3 beta(R*)))

Chemische & physikalische Eigenschaften

XLogP-0,9
Polarare Oberfläche (TPSA)172
H-Brücken-Donoren5
H-Brücken-Akzeptoren6
Frei drehbare Bindungen11
Schwere Atome25
Formalladung0
Komplexität518
Schmelzpunkt>170°C (dec.)
Dichte1.44±0.1 g/cm3(Predicted)
Lagerbedingungen2-8°C
LöslichkeitH2O: 20 mg/mL, clear, colorlessSoluble in DMSO (25mg/ml), or water (20mg/ml)
pKa (Säurekonstante)3.16±0.40(Predicted)
AggregatzustandWhite solid
FarbeWhite or off-white
Biologische Quellesynthetic (organic)
BRN1405664
StabilitätStable for 1 year from date of purchase as supplied.
InChIKeyLTLYEAJONXGNFG-DCAQKATOSA-N
SMILESO1[C@H](C(N[C@H](C(NCCCCNC(N)=N)=O)CC(C)C)=O)[C@H]1C(O)=O
CAS Datenbank66701-25-5(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-EinstufungThis chemical does not meet GHS hazard criteria for 75% (3 of 4) of all reports.WarningH371 (25%): May cause damage to organs [Warning Specific target organ toxicity, single exposure]P260, P264, P270, P308+P316, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 4 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard Classes and CategoriesSTOT SE 2 (25%)
F10
Wassergefährdungsklasse (WGK)3
Zollcode29252900
RTECS-Nr.RR0390000
Sicherheitshinweise (S)22-24/25
Lagerklasse11 - Combustible Solids

Anwendungen & Verwendung

Verwenden

It is used as a broad spectrum cysteine proteinase and calpain activation inhibitor. Additionally, Prevotella intermediate studies report that E-64 blocks the breakdown of methaemoglobin and the oxidation of oxyhaemoglobin by InpA. E-64 has also been used to study excystation in Giardia lamblia. E-64 is an inhibitor of Calpain, cathepsin K and cathepsin S. E-64 is an effective ligand for affinity purification of cysteine proteases. When coupled to a thiolated affinity matrix, binding is no longer irreversible, but specificity is retained