CHEBI:49845 - (R)-quinacrine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (R)-quinacrine
ChEBI ID CHEBI:49845
ChEBI ASCII Name (R)-quinacrine
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:37596, CHEBI:49844
Supplier Information
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Formula C23H30ClN3O
Net Charge 0
Average Mass 399.95662
Monoisotopic Mass 399.208
InChI InChI=1S/C23H30ClN3O/c1-5-27(6-2)13-7-8-16(3)25-23-19-11-9-17(24)14-22(19)26-21-12-10-18(28-4)15-20(21)23/h9-12,14-16H,5-8,13H2,1-4H3,(H,25,26)/t16-/m1/s1
InChIKey GPKJTRJOBQGKQK-MRXNPFEDSA-N
SMILES CCN(CC)CCC[C@@H](C)Nc1c2ccc(Cl)cc2nc2ccc(OC)cc12
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): EC 1.8.1.12 (trypanothione-disulfide reductase) inhibitor
An EC 1.8.1.* (oxidoreductase acting on sulfur group of donors, NAD+ or NADP+ as acceptor) inhibitor that interferes with the action of trypanothione-disulfide reductase (EC 1.8.1.12).
(via quinacrine )
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.
(via quinacrine )
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.
(via quinacrine )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (R)-quinacrine (CHEBI:49845) is a quinacrine (CHEBI:8711)
(R)-quinacrine (CHEBI:49845) is enantiomer of (S)-quinacrine (CHEBI:37597)
Incoming (S)-quinacrine (CHEBI:37597) is enantiomer of (R)-quinacrine (CHEBI:49845)
IUPAC Name
(4R)-N4-(6-chloro-2-methoxyacridin-9-yl)-N1,N1-diethylpentane-1,4-diamine
Synonym Source
QUINACRINE PDBeChem
Manual Xref Database
QUN PDBeChem
View more database links
Last Modified
19 September 2008