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Details

Stereochemistry ACHIRAL
Molecular Formula C4H4BrN3O
Molecular Weight 189.998
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-BROMOCYTOSINE

SMILES

NC1=C(Br)C=NC(=O)N1

InChI

InChIKey=QFVKLKDEXOWFSL-UHFFFAOYSA-N
InChI=1S/C4H4BrN3O/c5-2-1-7-4(9)8-3(2)6/h1H,(H3,6,7,8,9)

HIDE SMILES / InChI

Molecular Formula C4H4BrN3O
Molecular Weight 189.998
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Electrophysiological characterization of nicotinic acetylcholine receptors in cat petrosal ganglion neurons in culture: effects of cytisine and its bromo derivatives.
2006-02-09
Formation of intrastrand cross-link products between cytosine and adenine from UV irradiation of d((Br)CA) and duplex DNA containing a 5-bromocytosine.
2005-10-12
Analysis of vibrational spectra of 5-fluoro, 5-chloro and 5-bromo-cytosines based on density functional theory calculations.
2005-03
Lifetime regulation of the charge-separated state in DNA by modulating the oxidation potential of guanine in DNA through hydrogen bonding.
2004-10-13
Facile formation of an intrastrand cross-link lesion between cytosine and guanine upon pyrex-filtered UV light irradiation of d((Br)CG) and duplex DNA containing 5-bromocytosine.
2004-06-02
Activity of cytisine and its brominated isosteres on recombinant human alpha7, alpha4beta2 and alpha4beta4 nicotinic acetylcholine receptors.
2001-09
Substance Class Chemical
Created
by admin
on Mon Mar 31 22:07:51 GMT 2025
Edited
by admin
on Mon Mar 31 22:07:51 GMT 2025
Record UNII
2737MSZ714
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2(1H)-PYRIMIDINONE, 4-AMINO-5-BROMO-
Preferred Name English
5-BROMOCYTOSINE
Systematic Name English
4-AMINO-5-BROMO-2-HYDROXYPYRIMIDINE
Systematic Name English
2(1H)-PYRIMIDINONE, 6-AMINO-5-BROMO-
Systematic Name English
CYTOSINE, 5-BROMO-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
218-806-8
Created by admin on Mon Mar 31 22:07:51 GMT 2025 , Edited by admin on Mon Mar 31 22:07:51 GMT 2025
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EPA CompTox
DTXSID60176932
Created by admin on Mon Mar 31 22:07:51 GMT 2025 , Edited by admin on Mon Mar 31 22:07:51 GMT 2025
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PUBCHEM
75233
Created by admin on Mon Mar 31 22:07:51 GMT 2025 , Edited by admin on Mon Mar 31 22:07:51 GMT 2025
PRIMARY
FDA UNII
2737MSZ714
Created by admin on Mon Mar 31 22:07:51 GMT 2025 , Edited by admin on Mon Mar 31 22:07:51 GMT 2025
PRIMARY
CAS
2240-25-7
Created by admin on Mon Mar 31 22:07:51 GMT 2025 , Edited by admin on Mon Mar 31 22:07:51 GMT 2025
PRIMARY