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ChEBI
> Main
CHEBI:50199 - pefloxacin
Main
ChEBI Ontology
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ChEBI Name
pefloxacin
ChEBI ID
CHEBI:50199
Definition
A quinolone that is 4-oxo-1,4-dihydroquinoline which is substituted at positions 1, 3, 6 and 7 by ethyl, carboxy, fluorine, and 4-methylpiperazin-1-yl groups, respectively.
Stars
This entity has been manually annotated by the ChEBI Team.
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Read full article at Wikipedia
Formula
C17H20FN3O3
Net Charge
0
Average Mass
333.35740
Monoisotopic Mass
333.14887
InChI
InChI=1S/C17H20FN3O3/c1-
3-
20-
10-
12(17(23)
24)
16(22)
11-
8-
13(18)
15(9-
14(11)
20)
21-
6-
4-
19(2)
5-
7-
21/h8-
10H,3-
7H2,1-
2H3,(H,23,24)
InChIKey
FHFYDNQZQSQIAI-UHFFFAOYSA-N
SMILES
CCn1cc(C(O)=O)c(=O)c2cc(F)c(cc12)N1CCN(C)CC1
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
DNA synthesis inhibitor
Any substance that inhibits the synthesis of DNA.
antibacterial drug
A drug used to treat or prevent bacterial infections.
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via
quinolone antibiotic
)
(via
heterocyclic antibiotic
)
(via
fluoroquinolone antibiotic
)
Application
(s):
antiinfective agent
A substance used in the prophylaxis or therapy of infectious diseases.
antibacterial drug
A drug used to treat or prevent bacterial infections.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
pefloxacin (
CHEBI:50199
)
has role
antibacterial drug (
CHEBI:36047
)
pefloxacin (
CHEBI:50199
)
has role
antiinfective agent (
CHEBI:35441
)
pefloxacin (
CHEBI:50199
)
has role
DNA synthesis inhibitor (
CHEBI:59517
)
pefloxacin (
CHEBI:50199
)
is a
N
-alkylpiperazine (
CHEBI:46845
)
pefloxacin (
CHEBI:50199
)
is a
N
-arylpiperazine (
CHEBI:46848
)
pefloxacin (
CHEBI:50199
)
is a
fluoroquinolone antibiotic (
CHEBI:87211
)
pefloxacin (
CHEBI:50199
)
is a
monocarboxylic acid (
CHEBI:25384
)
pefloxacin (
CHEBI:50199
)
is a
quinolone (
CHEBI:23765
)
pefloxacin (
CHEBI:50199
)
is a
quinolone antibiotic (
CHEBI:86324
)
Incoming
pefloxacin mesylate (
CHEBI:50194
)
has part
pefloxacin (
CHEBI:50199
)
IUPAC Name
1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
INNs
Sources
pefloxacin
ChemIDplus
pefloxacino
ChemIDplus
pefloxacinum
ChemIDplus
Synonyms
Sources
Pefloxacine
ChemIDplus
perfloxacin
Note: (2015-04-15) Rare variant spelling.
ChEBI
PFLX
DrugBank
Brand Name
Source
Labocton
ChEBI
Manual Xrefs
Databases
2071
DrugCentral
D02306
KEGG DRUG
DB00487
DrugBank
DE2840910
Patent
HMDB0014630
HMDB
LSM-5653
LINCS
Pefloxacin
Wikipedia
US4292317
Patent
US5095112
Patent
View more database links
Registry Numbers
Types
Sources
567618
Reaxys Registry Number
Reaxys
567618
Beilstein Registry Number
Beilstein
70458-92-3
CAS Registry Number
ChemIDplus
Citations
Types
Sources
25879817
PubMed citation
Europe PMC
26292292
PubMed citation
Europe PMC
26963935
PubMed citation
Europe PMC
7622257
PubMed citation
Europe PMC
8713436
PubMed citation
Europe PMC
Last Modified
22 February 2017