Preferred Name

quinine

Synonyms

quinine

(-)-Quinine

(R)-(6-methoxyquinolin-4-yl)((2S,4S,8R)-8-vinylquinuclidin-2-yl)methanol

chinine

Chinin

quinina

(-)-quinine

Quinine

6'-methoxycinchonidine

(9R)-6'-methoxy-8alpha-cinchonan-9-ol

(R)-(-)-quinine

chininum

(8S,9R)-quinine

Definitions

A cinchona alkaloid that is cinchonidine in which the hydrogen at the 6-position of the quinoline ring is substituted by methoxy.

ID

http://purl.obolibrary.org/obo/CHEBI_15854

charge

0

database_cross_reference

PMID:11844668

PMID:12213073

PMID:12502361

PMID:15027870

PMID:16933872

PMID:12798326

PMID:10937718

PMID:17850126

PMID:15857133

PMID:2657065

CAS:130-95-0

PMID:8182707

PMID:11855978

PMID:14761192

PMID:18788725

KEGG:D08460

PMID:16524728

KEGG:C06526

PMID:15026051

PMID:12477351

Drug_Central:4523

PMID:17482816

PMID:15225721

PMID:17506538

PMID:11212126

PMID:11728183

PMID:2579237

Beilstein:91867

DrugBank:DB00468

PMID:11549443

KNApSAcK:C00002193

Wikipedia:Quinine

PMID:10891117

PMID:17570664

PMID:18348514

PMID:12217353

PMID:10821711

PMID:12127529

PMID:7009867

PMID:12873511

formula

C20H24N2O2

has parent hydride

http://purl.obolibrary.org/obo/CHEBI_59138

has role

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

http://purl.obolibrary.org/obo/CHEBI_35481

http://purl.obolibrary.org/obo/CHEBI_51371

has_alternative_id

CHEBI:355947

CHEBI:8723

CHEBI:15001

CHEBI:26499

CHEBI:569215

CHEBI:602929

CHEBI:127176

has_exact_synonym

quinine

Quinine

(9R)-6'-methoxy-8alpha-cinchonan-9-ol

has_obo_namespace

chebi_ontology

has_related_synonym

(-)-Quinine

(R)-(6-methoxyquinolin-4-yl)((2S,4S,8R)-8-vinylquinuclidin-2-yl)methanol

chinine

Chinin

quinina

(-)-quinine

6'-methoxycinchonidine

(R)-(-)-quinine

chininum

(8S,9R)-quinine

id

CHEBI:15854

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19-,20+/m0/s1

inchikey

LOUPRKONTZGTKE-WZBLMQSHSA-N

is conjugate base of

http://purl.obolibrary.org/obo/CHEBI_137041

label

quinine

mass

324.41680

monoisotopicmass

324.18378

notation

CHEBI:15854

prefLabel

quinine

smiles

[H][C@]1(C[C@@H]2CC[N@]1C[C@@H]2C=C)[C@H](O)c1ccnc2ccc(OC)cc12

textual definition

A cinchona alkaloid that is cinchonidine in which the hydrogen at the 6-position of the quinoline ring is substituted by methoxy.

subClassOf

http://purl.obolibrary.org/obo/CHEBI_51323

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http://purl.bioontology.org/ontology/VANDF/4019926 VANDF LOOM
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http://purl.bioontology.org/ontology/CSP/2532-8110 CRISP LOOM
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http://purl.obolibrary.org/obo/CHEBI_15854 BIOMODELS LOOM
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