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The Drug Ontology
Last uploaded:
December 20, 2024
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| Preferred Name | quinine | |
| Synonyms |
(8S,9R)-quinine (-)-Quinine (R)-(-)-quinine (R)-(6-methoxyquinolin-4-yl)((2S,4S,8R)-8-vinylquinuclidin-2-yl)methanol (-)-quinine 6'-methoxycinchonidine Chinin chinine chininum quinina (9R)-6'-methoxy-8alpha-cinchonan-9-ol Quinine 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 |
|
| alternative label |
(8S,9R)-quinine (-)-Quinine (R)-(-)-quinine (R)-(6-methoxyquinolin-4-yl)((2S,4S,8R)-8-vinylquinuclidin-2-yl)methanol (-)-quinine 6'-methoxycinchonidine Chinin chinine chininum quinina (9R)-6'-methoxy-8alpha-cinchonan-9-ol Quinine quinine
|
|
| charge |
0
|
|
| database_cross_reference |
PMID:11212126 PMID:12798326 PMID:16933872 PMID:15026051 PMID:15225721 CAS:130-95-0 Beilstein:91867 PMID:11844668 KEGG:C06526 PMID:10821711 PMID:11855978 PMID:14761192 Wikipedia:Quinine PMID:12502361 PMID:17570664 PMID:17850126 PMID:7009867 PMID:18788725 PMID:11728183 PMID:2579237 KEGG:D08460 PMID:2657065 PMID:12213073 PMID:10891117 Drug_Central:4523 PMID:12873511 PMID:15027870 PMID:16524728 KNApSAcK:C00002193 PMID:17482816 PMID:10937718 PMID:11549443 PMID:17506538 PMID:15857133 PMID:18348514 DrugBank:DB00468 PMID:12217353 PMID:12127529 PMID:12477351 PMID:8182707
|
|
| definition |
A cinchona alkaloid that is cinchonidine in which the hydrogen at the 6-position of the quinoline ring is substituted by methoxy.
|
|
| formula |
C20H24N2O2
|
|
| has characteristic |
http://purl.obolibrary.org/obo/CHEBI_51371 |
|
| has parent hydride | ||
| has role |
http://purl.obolibrary.org/obo/CHEBI_51371 |
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| has_alternative_id |
CHEBI:355947 CHEBI:127176 CHEBI:26499 CHEBI:569215 CHEBI:15001 CHEBI:602929 CHEBI:8723
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|
| has_exact_synonym |
(9R)-6'-methoxy-8alpha-cinchonan-9-ol Quinine quinine
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
(8S,9R)-quinine (-)-Quinine (R)-(-)-quinine (R)-(6-methoxyquinolin-4-yl)((2S,4S,8R)-8-vinylquinuclidin-2-yl)methanol (-)-quinine 6'-methoxycinchonidine Chinin chinine chininum quinina
|
|
| has_RxCUI |
9071
|
|
| id |
CHEBI:15854
|
|
| in_subset | ||
| 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
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|
| inchikey |
LOUPRKONTZGTKE-WZBLMQSHSA-N
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|
| is conjugate base of | ||
| label |
quinine
|
|
| mass |
324.41680
|
|
| monoisotopicmass |
324.18378
|
|
| notation |
CHEBI:15854
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|
| prefLabel |
quinine
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|
| smiles |
[H][C@]1(C[C@@H]2CC[N@]1C[C@@H]2C=C)[C@H](O)c1ccnc2ccc(OC)cc12
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| subClassOf |
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