ChEBI logo

ChEBI


    The database and ontology of Chemical Entities of Biological Interest

spacer

chloroquine (CHEBI:3638)

Search for only All in ChEBI

Main     ChEBI Ontology     Automatic Xrefs      
ChEBI Name chloroquine
ChEBI ID CHEBI:3638
Definition An aminoquinoline that is quinoline which is substituted at position 4 by a [5-(diethylamino)pentan-2-yl]amino group at at position 7 by chlorine. It is used for the treatment of malaria, hepatic amoebiasis, lupus erythematosus, light-sensitive skin eruptions, and rheumatoid arthritis.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
See structure as:  Image  Applet
Save molfile Download Molfile
more structures >>
Wikipedia License
Waiting for wikipedia content
Read full article at Wikipedia
Formula Source
C18H26ClN3 ChEBI
Net Charge 0
Average Mass 319.87200
InChI
InChI=1S/C18H26ClN3/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21)
InChIKey
WHTVZRBIWZFKQO-UHFFFAOYSA-N
SMILES
CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12
Roles Classification
Biological Role(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.
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.
antirheumatic drug
A drug used to treat rheumatoid arthritis.
dermatologic drug
A drug used to treat or prevent skin disorders or for the routine care of skin.
View more on the ChEBI Ontology
ChEBI Ontology
Outgoing chloroquine (CHEBI:3638) has role antimalarial (CHEBI:38068)
chloroquine (CHEBI:3638) has role antirheumatic drug (CHEBI:35842)
chloroquine (CHEBI:3638) has role dermatologic drug (CHEBI:50177)
chloroquine (CHEBI:3638) is a aminoquinoline (CHEBI:36709)
chloroquine (CHEBI:3638) is a organochlorine compound (CHEBI:36683)
chloroquine (CHEBI:3638) is a secondary amino compound (CHEBI:50995)
chloroquine (CHEBI:3638) is a tertiary amino compound (CHEBI:50996)
Incoming hydroxychloroquine (CHEBI:5801) has functional parent chloroquine (CHEBI:3638)
chloroquine sulfate (CHEBI:50178) has part chloroquine (CHEBI:3638)
(R)-chloroquine (CHEBI:48811) is a chloroquine (CHEBI:3638)
(S)-chloroquine (CHEBI:39254) is a chloroquine (CHEBI:3638)
IUPAC Name
N4-(7-chloroquinolin-4-yl)-N1,N1-diethylpentane-1,4-diamine
INNs Sources
chloroquine WHO MedNet
chloroquine ChemIDplus
chloroquinum ChemIDplus
cloroquina ChemIDplus
Synonyms Sources
Chlorochin ChemIDplus
Chloroquine KEGG COMPOUND
N4-(7-chloro-4-quinolinyl)-N1,N1-diethyl-1,4-pentanediamine NIST Chemistry WebBook
Brand Names Sources
Aralen DrugBank
Artrichin DrugBank
Bemaphate DrugBank
Capquin DrugBank
Nivaquine B DrugBank
Resoquine DrugBank
Reumachlor DrugBank
Sanoquin DrugBank
Database Links Databases
C07625 KEGG COMPOUND
Chloroquine Wikipedia
CLQ PDBeChem
D02366 KEGG DRUG
DB00608 DrugBank
DE683692 Patent
HMDB14746 HMDB
US2233970 Patent
View more database links
Registry Numbers Types Sources
482809 Beilstein Registry Number Beilstein
482809 Reaxys Registry Number Reaxys
54-05-7 CAS Registry Number KEGG COMPOUND
54-05-7 CAS Registry Number ChemIDplus
54-05-7 CAS Registry Number NIST Chemistry WebBook
781126 Gmelin Registry Number Gmelin
Citations Waiting for Citations Types Sources
11198399 PubMed citation CiteXplore
17594118 PubMed citation CiteXplore
18052874 PubMed citation CiteXplore
19426658 PubMed citation CiteXplore
23288916 PubMed citation CiteXplore
23580861 PubMed citation CiteXplore
23635029 PubMed citation CiteXplore
23644906 PubMed citation CiteXplore
23706562 PubMed citation CiteXplore
23852712 PubMed citation CiteXplore
23891850 PubMed citation CiteXplore
General Comment
2014-07-14 Chloroquine can be found in blood and urine samples of individuals who have taken this drug.
 
Last Modified
14 juillet 2014

spacer
spacer