CHEBI:30270 - E64

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name E64
ChEBI ID CHEBI:30270
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:42162, CHEBI:4729, CHEBI:30208
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Formula C15H27N5O5
Net Charge 0
Average Mass 357.40558
Monoisotopic Mass 357.20122
InChI InChI=1S/C15H27N5O5/c1-8(2)7-9(20-13(22)10-11(25-10)14(23)24)12(21)18-5-3-4-6-19-15(16)17/h8-11H,3-7H2,1-2H3,(H,18,21)(H,20,22)(H,23,24)(H4,16,17,19)/t9-,10-,11-/m0/s1
InChIKey LTLYEAJONXGNFG-DCAQKATOSA-N
SMILES CC(C)C[C@H](NC(=O)[C@H]1O[C@@H]1C(O)=O)C(=O)NCCCCNC(N)=N
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): protease inhibitor
A compound which inhibits or antagonizes the biosynthesis or actions of proteases (endopeptidases).
antimalarial
A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
Application(s): antimalarial
A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
antiparasitic agent
A substance used to treat or prevent parasitic infections.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing E64 (CHEBI:30270) has role antimalarial (CHEBI:38068)
E64 (CHEBI:30270) has role antiparasitic agent (CHEBI:35442)
E64 (CHEBI:30270) has role protease inhibitor (CHEBI:37670)
E64 (CHEBI:30270) is a L-leucine derivative (CHEBI:25018)
E64 (CHEBI:30270) is a dicarboxylic acid monoamide (CHEBI:35735)
E64 (CHEBI:30270) is a epoxy monocarboxylic acid (CHEBI:23931)
E64 (CHEBI:30270) is a guanidines (CHEBI:24436)
Synonyms Sources
(2S,3S)-3-(N-{(S)-1-[N-(4-guanidinobutyl)carbamoyl]3-methylbutyl}carbamoyl)oxirane-2-carboxylic acid IUBMB
(2S,3S)-3-[((1S)-1-{[4-(carbamimidamido)butyl]carbamoyl}-3-methylbutyl)carbamoyl]oxirane-2-carboxylic acid IUPAC
E 64 ChemIDplus
E-64 KEGG COMPOUND
Manual Xrefs Databases
C01341 KEGG COMPOUND
DB04276 DrugBank
E-64 Wikipedia
E64 PDBeChem
View more database links
Registry Numbers Types Sources
6666631 Beilstein Registry Number Beilstein
66701-25-5 CAS Registry Number ChemIDplus
Last Modified
18 May 2017