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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:67135 - 2-nitroimidazole
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ChEBI Ontology
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ChEBI Name
2-nitroimidazole
ChEBI ID
CHEBI:67135
Definition
An imidazole that is 1
H
-imidazole substituted at position 2 by a nitro group.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
KAX
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Formula
C3H3N3O2
Net Charge
0
Average Mass
113.07480
Monoisotopic Mass
113.02253
InChI
InChI=1S/C3H3N3O2/c7-6(8)3-4-1-2-5-3/h1-2H,(H,4,5)
InChIKey
YZEUHQHUFTYLPH-UHFFFAOYSA-N
SMILES
[O-][N+](=O)c1ncc[nH]1
Roles Classification
Biological Role
(s):
antitubercular agent
A substance that kills or slows the growth of
Mycobacterium tuberculosis
and is used in the treatment of tuberculosis.
Application
(s):
antitubercular agent
A substance that kills or slows the growth of
Mycobacterium tuberculosis
and is used in the treatment of tuberculosis.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
2-nitroimidazole (
CHEBI:67135
)
has functional parent
1
H
-imidazole (
CHEBI:16069
)
2-nitroimidazole (
CHEBI:67135
)
has role
antitubercular agent (
CHEBI:33231
)
2-nitroimidazole (
CHEBI:67135
)
is a
C
-nitro compound (
CHEBI:35716
)
2-nitroimidazole (
CHEBI:67135
)
is a
imidazoles (
CHEBI:24780
)
IUPAC Name
2-nitro-1
H
-imidazole
Synonyms
Sources
2-nitroimidazole
UniProt
Amicin
ChemIDplus
Azomycin
ChemIDplus
nitroimidazole
ChEBI
Manual Xref
Database
C14531
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
116444
Reaxys Registry Number
Reaxys
527-73-1
CAS Registry Number
KEGG COMPOUND
527-73-1
CAS Registry Number
ChemIDplus
Citations
Types
Sources
21244596
PubMed citation
SUBMITTER
22710102
PubMed citation
Europe PMC
22816283
PubMed citation
Europe PMC
Last Modified
28 July 2014