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> Main
CHEBI:75335 - 4-nitroanthranilic acid
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ChEBI Name
4-nitroanthranilic acid
ChEBI ID
CHEBI:75335
Definition
An aminobenzoic acid that is anthranilic acid with a nitro substituent at position 4.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C7H6N2O4
Net Charge
0
Average Mass
182.13350
Monoisotopic Mass
182.03276
InChI
InChI=1S/C7H6N2O4/c8-6-3-4(9(12)13)1-2-5(6)7(10)11/h1-3H,8H2,(H,10,11)
InChIKey
UEALKTCRMBVTFN-UHFFFAOYSA-N
SMILES
Nc1cc(ccc1C(O)=O)[N+]([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):
mutagen
An agent that increases the frequency of mutations above the normal background level, usually by interacting directly with DNA and causing it damage, including base substitution.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
4-nitroanthranilic acid (
CHEBI:75335
)
has functional parent
anthranilic acid (
CHEBI:30754
)
4-nitroanthranilic acid (
CHEBI:75335
)
has role
mutagen (
CHEBI:25435
)
4-nitroanthranilic acid (
CHEBI:75335
)
is a
aminobenzoic acid (
CHEBI:22495
)
4-nitroanthranilic acid (
CHEBI:75335
)
is a
nitrobenzoic acid (
CHEBI:25553
)
Incoming
2-(benzoylamino)-4-nitrobenzoic acid (
CHEBI:75334
)
has functional parent
4-nitroanthranilic acid (
CHEBI:75335
)
IUPAC Name
2-amino-4-nitrobenzoic acid
Registry Numbers
Types
Sources
619-17-0
CAS Registry Number
ChemIDplus
785071
Reaxys Registry Number
Reaxys
Citations
Types
Sources
12799682
PubMed citation
Europe PMC
16097390
PubMed citation
Europe PMC
3328032
PubMed citation
Europe PMC
4024104
PubMed citation
Europe PMC
8851823
PubMed citation
Europe PMC
Last Modified
27 August 2013