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lumefantrine (CHEBI:156095)

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ChEBI Name lumefantrine
ChEBI ID CHEBI:156095
Definition Lumefantrine is an antimalarial drug used in combination with artemether for the treatment of multi-drug resistant strains of falciparum malaria.
Last Modified 03 November 2009
Stars This entity has been manually annotated by the ChEBI Team.

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InChI
InChI=1/C30H32Cl3NO/c1-3-5-13-34(14-6-4-2)19-29(35)28-18-23(33)17-27-25(15-20-7-9-21(31)10-8-20)26-16-22(32)11-12-24(26)30(27)28/h7-12,15-18,29,35H,3-6,13-14,19H2,1-2H3/b25-15-
InChIKey
InChIKey=DYLGFOYVTXJFJP-MYYYXRDXBY
SMILES
CCCCN(CCCC)CC(O)c1cc(Cl)cc2\C(=C/c3ccc(Cl)cc3)c3cc(Cl)ccc3-c12
Formula Source
C30H32Cl3NO ChEBI
Charge 0
Mass 528.94000
ChEBI Ontology
Tree view
Outgoing lumefantrine (CHEBI:156095) is a organochlorine compound (CHEBI:36683)
lumefantrine (CHEBI:156095) is a tertiary amine (CHEBI:32876)
lumefantrine (CHEBI:156095) has role antimalarial (CHEBI:38068)
IUPAC Name
2-(dibutylamino)-1-[(9Z)-2,7-dichloro-9-(4-chlorobenzylidene)-9H-fluoren-4-yl]ethanol
INN Source
Lumefantrine KEGG DRUG
Synonyms Sources
(±)-2,7-Dichloro-9-((Z)-p-chlorobenzylidene)-α-((dibutylamino)methyl)fluorene-4-methanol ChemIDplus
2-Dibutylamino-1-[2,7-dichloro-9-(4-chloro-benzylidene)-9H-fluoren-4-yl]-ethanol ChEMBL
2-Dibutylamino-1-{2,7-dichloro-9-[1-(4-chloro-phenyl)-meth-(Z)-ylidene]-9H-fluoren-4-yl}-ethanol ChEMBL
Benflumetol ChemIDplus
dl-Benflumelol ChemIDplus
Database Links Databases
D03821 KEGG DRUG
56095 ChEMBL
Registry Numbers Types Sources
82186-77-4 CAS Registry Number KEGG DRUG
82186-77-4 CAS Registry Number ChemIDplus
8811003 Beilstein Registry Number Beilstein
Citations Waiting for Citations Types Sources
12565929 PubMed citation ChEMBL
12699750 PubMed citation ChEMBL
12798326 PubMed citation ChEMBL

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