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(Q82898823)
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English
1-(2-Deoxypentofuranosyl)-5-(1,2-dihydroxyethyl)-4-hydroxypyrimidin-2(1H)-one
group of stereoisomers with the chemical formula C₁₁H₁₆N₂O₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
288.095750852
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₁H₁₆N₂O₇
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
O=c1nc(O)c(C(O)CO)cn1C1CC(O)C(CO)O1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
O=c1nc(O)c(C(O)CO)cn1[C@H]1C[C@H](O)[C@@H](CO)O1
1 reference
based on heuristic
inferred from InChI
catalog
CAS COVID-19 Anti-Viral Candidate Compounds
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Identifiers
InChI
InChI=1S/C11H16N2O7/c14-3-7(17)5-2-13(11(19)12-10(5)18)9-1-6(16)8(4-15)20-9/h2,6-9,14-17H,1,3-4H2,(H,12,18,19)/t6-,7?,8+,9+/m0/s1
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InChIKey
HBEZJIPJVVECAF-KKVHJZIVSA-N
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CAS Registry Number
123881-99-2
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PubChem CID
5271958
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
51640151
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90924625
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DSSTOX compound identifier
DTXCID401353462
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