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Details

Stereochemistry ACHIRAL
Molecular Formula C4H4ClN3O
Molecular Weight 145.547
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-CHLOROCYTOSINE

SMILES

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

InChI

InChIKey=PNWOYKVCNDZOLS-UHFFFAOYSA-N
InChI=1S/C4H4ClN3O/c5-2-1-7-4(9)8-3(2)6/h1H,(H3,6,7,8,9)

HIDE SMILES / InChI

Molecular Formula C4H4ClN3O
Molecular Weight 145.547
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Synthesis and characterization of oligonucleotides containing 5-chlorocytosine.
2004 Sep
Analysis of vibrational spectra of 5-fluoro, 5-chloro and 5-bromo-cytosines based on density functional theory calculations.
2005 Mar
Examination of hypochlorous acid-induced damage to cytosine residues in a CpG dinucleotide in DNA.
2008 Jun
[Markers of chloric acid (I) in biological systems--identification and properties].
2010
Comparative study of HOCl-inflicted damage to bacterial DNA ex vivo and within cells.
2010 Jan 15
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:11:55 GMT 2023
Edited
by admin
on Fri Dec 15 19:11:55 GMT 2023
Record UNII
ZBC12IW74E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-CHLOROCYTOSINE
Systematic Name English
2(1H)-PYRIMIDINONE, 6-AMINO-5-CHLORO-
Systematic Name English
CYTOSINE, 5-CHLORO-
Systematic Name English
2(1H)-PYRIMIDINONE, 4-AMINO-5-CHLORO-
Systematic Name English
Code System Code Type Description
CAS
2347-43-5
Created by admin on Fri Dec 15 19:11:55 GMT 2023 , Edited by admin on Fri Dec 15 19:11:55 GMT 2023
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PUBCHEM
3083758
Created by admin on Fri Dec 15 19:11:55 GMT 2023 , Edited by admin on Fri Dec 15 19:11:55 GMT 2023
PRIMARY
FDA UNII
ZBC12IW74E
Created by admin on Fri Dec 15 19:11:55 GMT 2023 , Edited by admin on Fri Dec 15 19:11:55 GMT 2023
PRIMARY
EPA CompTox
DTXSID70178023
Created by admin on Fri Dec 15 19:11:55 GMT 2023 , Edited by admin on Fri Dec 15 19:11:55 GMT 2023
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