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> Main
CHEBI:78042 - 5-fluoroanthranilic acid
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ChEBI Name
5-fluoroanthranilic acid
ChEBI ID
CHEBI:78042
Definition
An aminobenzoic acid that is anthranilic acid in which the hydrogen at position 5 on the phenyl ring is replaced by fluorine.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C7H6FNO2
Net Charge
0
Average Mass
155.12640
Monoisotopic Mass
155.03826
InChI
InChI=1S/C7H6FNO2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,9H2,(H,10,11)
InChIKey
FPQMGQZTBWIHDN-UHFFFAOYSA-N
SMILES
Nc1ccc(F)cc1C(O)=O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
Biological Role
(s):
antimetabolite
A substance which is structurally similar to a metabolite but which competes with it or replaces it, and so prevents or reduces its normal utilization.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
5-fluoroanthranilic acid (
CHEBI:78042
)
has functional parent
anthranilic acid (
CHEBI:30754
)
5-fluoroanthranilic acid (
CHEBI:78042
)
has role
antimetabolite (
CHEBI:35221
)
5-fluoroanthranilic acid (
CHEBI:78042
)
is a
aminobenzoic acid (
CHEBI:22495
)
5-fluoroanthranilic acid (
CHEBI:78042
)
is a
organofluorine compound (
CHEBI:37143
)
Synonym
Source
2-amino-5-fluorobenzoic acid
ChEBI
Manual Xrefs
Databases
CN1477097
Patent
CPD0-1487
MetaCyc
EP0647614
Patent
EP0647615
Patent
View more database links
Registry Numbers
Types
Sources
2803664
Reaxys Registry Number
Reaxys
446-08-2
CAS Registry Number
ChemIDplus
Citations
Types
Sources
10790693
PubMed citation
Europe PMC
21497545
PubMed citation
Europe PMC
22618436
PubMed citation
Europe PMC
Last Modified
02 April 2014