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The Prescription of Drugs Ontology
Last uploaded:
September 4, 2020
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| Preferred Name | grepafloxacin | |
| Synonyms |
grepafloxacin HCl tomefloxacin grepafloxacin hydrochloride hydrate grepafloxacin hydrochloride Grepafloxacin |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_5543 |
|
| alternative term |
grepafloxacin HCl tomefloxacin grepafloxacin hydrochloride hydrate grepafloxacin hydrochloride Grepafloxacin
|
|
| charge |
0
|
|
| database_cross_reference |
HMDB:HMDB0014509 Drug_Central:1330 KEGG:C11368 CAS:119914-60-2
|
|
| formula |
C19H22FN3O3
|
|
| has_exact_synonym |
Grepafloxacin
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
grepafloxacin HCl tomefloxacin grepafloxacin hydrochloride hydrate grepafloxacin hydrochloride
|
|
| has_RxCUI |
83719
|
|
| id |
CHEBI:5543
|
|
| in_subset | ||
| inchi |
InChI=1S/C19H22FN3O3/c1-10-8-22(6-5-21-10)15-7-14-16(11(2)17(15)20)18(24)13(19(25)26)9-23(14)12-3-4-12/h7,9-10,12,21H,3-6,8H2,1-2H3,(H,25,26)
|
|
| inchikey |
AIJTTZAVMXIJGM-UHFFFAOYSA-N
|
|
| label |
Grepafloxacin grepafloxacin
|
|
| mass |
359.395
|
|
| monoisotopicmass |
359.16452
|
|
| notation |
CHEBI:5543
|
|
| prefixIRI |
CHEBI:5543
|
|
| prefLabel |
grepafloxacin
|
|
| smiles |
CC1CN(CCN1)c1cc2n(cc(C(O)=O)c(=O)c2c(C)c1F)C1CC1
|
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_87211 |
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