The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
Preferred Name

quinacrine
Synonyms

6-chloro-9-((4-(diethylamino)-1-methylbutyl)amino)-2-methoxyacridine

mepacrine

C23H30ClN3O

2-methoxy-6-chloro-9-diethylaminopentylaminoacridine

{4-[(6-chloro-2-methoxyacridin-9-yl)amino]pentyl}diethylamine

Quinacrine

4-N-(6-chloro-2-methoxyacridin-9-yl)-1-N,1-N-diethylpentane-1,4-diamine

N(4)-(6-chloro-2-methoxy-9-acridinyl)-N(1),N(1)-diethyl-1,4-pentanediamine

3-chloro-7-methoxy-9-(1-methyl-4-diethylaminobutylamino)acridine

ID

http://purl.obolibrary.org/obo/CHEBI_8711

binds

http://purl.obolibrary.org/obo/dinto_1979

http://purl.obolibrary.org/obo/dinto_0830

http://purl.obolibrary.org/obo/dinto_1440

http://purl.obolibrary.org/obo/dinto_3334

http://purl.obolibrary.org/obo/dinto_0856

http://purl.obolibrary.org/obo/dinto_2359

http://purl.obolibrary.org/obo/dinto_2873

http://purl.obolibrary.org/obo/dinto_2990

http://purl.obolibrary.org/obo/dinto_0901

CASRN

83-89-6

DBBrand

acrichine

atebrin

mepacrine

antimalarina

acriquine

akrichin

italchine

erion hydrochloride

erion

acrinamine

atabrine

haffkinine

quinactine

atebrine

DBname

quinacrine

DBSynonym

quinacrine dihydrochloride

Definition

An acridine that has formula C23H30ClN3O.

has pharmacological target

http://purl.obolibrary.org/obo/dinto_2873

http://purl.obolibrary.org/obo/dinto_0830

http://purl.obolibrary.org/obo/dinto_3334

http://purl.obolibrary.org/obo/dinto_0856

has role

http://purl.obolibrary.org/obo/CHEBI_38068

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)

InChIKey

InChIKey=GPKJTRJOBQGKQK-UHFFFAOYSA-N

inhibits

http://purl.obolibrary.org/obo/dinto_1979

http://purl.obolibrary.org/obo/dinto_0830

http://purl.obolibrary.org/obo/dinto_1440

http://purl.obolibrary.org/obo/dinto_3334

http://purl.obolibrary.org/obo/dinto_0856

http://purl.obolibrary.org/obo/dinto_2359

is metabolised by

http://purl.obolibrary.org/obo/dinto_2990

http://purl.obolibrary.org/obo/dinto_0901

is substrate of

http://purl.obolibrary.org/obo/dinto_2990

http://purl.obolibrary.org/obo/dinto_0901

label

quinacrine

may interact with

http://purl.obolibrary.org/obo/CHEBI_127342

prefixIRI

obo2:CHEBI_8711

prefLabel

quinacrine

related with

http://purl.obolibrary.org/obo/dinto_2873

SMILES

CCN(CC)CCCC(C)NC1=C2C=C(OC)C=CC2=NC2=C1C=CC(Cl)=C2

CCN(CC)CCCC(C)Nc1c2ccc(Cl)cc2nc2ccc(OC)cc12

Synonym

6-chloro-9-((4-(diethylamino)-1-methylbutyl)amino)-2-methoxyacridine

mepacrine

C23H30ClN3O

2-methoxy-6-chloro-9-diethylaminopentylaminoacridine

{4-[(6-chloro-2-methoxyacridin-9-yl)amino]pentyl}diethylamine

Quinacrine

4-N-(6-chloro-2-methoxyacridin-9-yl)-1-N,1-N-diethylpentane-1,4-diamine

N(4)-(6-chloro-2-methoxy-9-acridinyl)-N(1),N(1)-diethyl-1,4-pentanediamine

3-chloro-7-methoxy-9-(1-methyl-4-diethylaminobutylamino)acridine

xref

DrugBank:DB01103

PDB:QUM

Beilstein:95500

ChEBI:8711

KEGG COMPOUND:C07339

Beilstein:497807

CASRN:83-89-6

PubChem Compound:237

PubChem Substance:46507828

PharmGKB:PA164745551

Wikipedia:http://en.wikipedia.org/wiki/Quinacrine

ChEMBL:102355

ChemSpider:232

subClassOf

http://purl.obolibrary.org/obo/dinto_000055

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http://purl.obolibrary.org/obo/CHEBI_8711 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_8711 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_8711 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_8711 FB-CV SAME_URI
http://purl.obolibrary.org/obo/CHEBI_8711 DDSS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_8711 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_8711 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_8711 NIFSTD SAME_URI
http://purl.obolibrary.org/obo/CHEBI_8711 PECO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_8711 DRON SAME_URI
http://purl.bioontology.org/ontology/SNOMEDCT/387445007 SNOMEDCT LOOM
http://purl.obolibrary.org/obo/MESH_D011796 BERO LOOM
https://go.drugbank.com/drugs/DB01103 MDM LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0034403 OCHV LOOM
http://purl.jp/bio/4/id/200906069651013379 IOBC LOOM
http://purl.obolibrary.org/obo/CHEBI_8711 DRON LOOM
http://purl.obolibrary.org/obo/CHEBI_8711 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_8711 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_8711 FB-CV LOOM
http://purl.obolibrary.org/obo/CHEBI_8711 DDSS LOOM
http://purl.obolibrary.org/obo/CHEBI_8711 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_8711 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_8711 NIFSTD LOOM
http://purl.obolibrary.org/obo/CHEBI_8711 PECO LOOM
http://purl.obolibrary.org/obo/CHEBI_8711 DRON LOOM
http://purl.obolibrary.org/obo/NCIT_C87656 BERO LOOM
http://purl.bioontology.org/ontology/MESH/D011796 MESH LOOM
http://purl.bioontology.org/ontology/LNC/MTHU007608 LOINC LOOM
http://stirdf.jst.go.jp/id/200907023194659458 IOBC LOOM
http://www.phoc.org.cn/pmo/class/PMO_00017954 PMAPP-PMO LOOM
http://purl.bioontology.org/ontology/LNC/LP19205-1 LOINC LOOM
http://purl.bioontology.org/ontology/RXNORM/9061 RXNORM LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C87656 NCIT LOOM
http://purl.bioontology.org/ontology/VANDF/4019924 VANDF LOOM
http://doe-generated-ontology.com/OntoAD#C0034403 ONTOAD LOOM
http://purl.obolibrary.org/obo/OMIT_0012730 OMIT LOOM
http://www.drugbank.ca/drugs/DB01103 FTC LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#10491 OCHV LOOM
http://purl.bioontology.org/ontology/NDDF/004871 NDDF LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D011796 RH-MESH LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000148009 NDFRT LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.494.046.250.760 RH-MESH LOOM
http://purl.bioontology.org/ontology/SNMI/C-56A70 SNMI LOOM