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English
5-Bromo-1-(2-chloro-2-deoxypentofuranosyl)-4-hydroxypyrimidin-2(1H)-one
chemical compound
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
339.94616119999995
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₁₀BrClN₂O₅
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
O=c1nc(O)c(Br)cn1C1OC(CO)C(O)C1Cl
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
O=c1nc(O)c(Br)cn1C1O[C@H](CO)[C@@H](O)[C@H]1Cl
1 reference
based on heuristic
inferred from InChI
catalog
CAS COVID-19 Anti-Viral Candidate Compounds
0 references
Identifiers
InChI
InChI=1S/C9H10BrClN2O5/c10-3-1-13(9(17)12-7(3)16)8-5(11)6(15)4(2-14)18-8/h1,4-6,8,14-15H,2H2,(H,12,16,17)/t4-,5-,6-,8?/m1/s1
0 references
InChIKey
RTWLWBAJWOUKKC-CDRSNLLMSA-N
0 references
CAS Registry Number
55612-19-6
0 references
PubChem CID
124296
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
RTWLWBAJWOUKKC-CDRSNLLMSA-N
UniChem compound ID
49891856
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40970955
1 reference
matched by identifier from
InChIKey
InChIKey
RTWLWBAJWOUKKC-CDRSNLLMSA-N
DSSTOX compound identifier
DTXCID701398477
0 references
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