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Chemical Entities of Biological Interest Ontology
| Preferred Name | gatifloxacin | |
| Synonyms |
gatifloxacine gatifloxacinum gatifloxacin 1-cyclopropyl-6-fluoro- 8-methoxy-7-(3-methylpiperazin-1-yl)- 4-oxo-quinoline-3-carboxylic acid AM 1155 1-Cyclopropyl-1,4-dihydro-6-fluoro-8-methoxy-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid gatifloxacino 1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid |
|
| Definitions |
A monocarboxylic acid that is 4-oxo-1,4-dihydroquinoline-3-carboxylic acid which is substituted on the nitrogen by a cyclopropyl group and at positions 6, 7, and 8 by fluoro, 3-methylpiperazin-1-yl, and methoxy groups, respectively. Gatifloxacin is an antibiotic of the fourth-generation fluoroquinolone family, that like other members of that family, inhibits the bacterial topoisomerase type-II enzymes. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_5280 |
|
| charge |
0
|
|
| database_cross_reference |
Reaxys:7445861 PMID:17116668 PMID:17960928 Patent:EP230295 PMID:17933535 Drug_Central:1280 PMID:17325221 PMID:18078756 PMID:7473575 PMID:17804222 PMID:17064062 PMID:10737746 PMID:18304818 PMID:12620077 PMID:26963935 PMID:16337791 Gmelin:2281206 PMID:17296740 PMID:12904069 Wikipedia:Gatifloxacin LINCS:LSM-5139 PMID:17043111 PMID:17276057 PMID:17387152 KEGG:D08011 PMID:12190308 PMID:17220425 PMID:17261623 DrugBank:DB01044 KEGG:C07661 PMID:15125930 PMID:17043131 PMID:15911273 PMID:12873512 PMID:16554151 PMID:16759086 Patent:US4980470 CAS:112811-59-3 PMID:16078842 PMID:17116666 PMID:17157008 PMID:15745831
|
|
| definition |
A monocarboxylic acid that is 4-oxo-1,4-dihydroquinoline-3-carboxylic acid which is substituted on the nitrogen by a cyclopropyl group and at positions 6, 7, and 8 by fluoro, 3-methylpiperazin-1-yl, and methoxy groups, respectively. Gatifloxacin is an antibiotic of the fourth-generation fluoroquinolone family, that like other members of that family, inhibits the bacterial topoisomerase type-II enzymes.
|
|
| formula |
C19H22FN3O4
|
|
| has role |
http://purl.obolibrary.org/obo/CHEBI_35441 |
|
| has_alternative_id |
CHEBI:101712
|
|
| has_exact_synonym |
1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
gatifloxacine gatifloxacinum gatifloxacin 1-cyclopropyl-6-fluoro- 8-methoxy-7-(3-methylpiperazin-1-yl)- 4-oxo-quinoline-3-carboxylic acid AM 1155 1-Cyclopropyl-1,4-dihydro-6-fluoro-8-methoxy-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid gatifloxacino
|
|
| id |
CHEBI:5280
|
|
| in_subset | ||
| inchi |
InChI=1S/C19H22FN3O4/c1-10-8-22(6-5-21-10)16-14(20)7-12-15(18(16)27-2)23(11-3-4-11)9-13(17(12)24)19(25)26/h7,9-11,21H,3-6,8H2,1-2H3,(H,25,26)
|
|
| inchikey |
XUBOMFCQGDBHNK-UHFFFAOYSA-N
|
|
| label |
gatifloxacin
|
|
| mass |
375.39410
|
|
| monoisotopicmass |
375.15943
|
|
| notation |
CHEBI:5280
|
|
| prefLabel |
gatifloxacin
|
|
| smiles |
COc1c(N2CCNC(C)C2)c(F)cc2c1n(cc(C(O)=O)c2=O)C1CC1
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|
| treeView |
http://purl.obolibrary.org/obo/CHEBI_37143 http://purl.obolibrary.org/obo/CHEBI_46848 http://purl.obolibrary.org/obo/CHEBI_23765 |
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_37143 http://purl.obolibrary.org/obo/CHEBI_46848 http://purl.obolibrary.org/obo/CHEBI_23765 |
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