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(Q82599096)
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English
1-[(2xi)-beta-D-threo-Pentofuranosyl](5,6-~2~H_2_)pyrimidine-2,4(1H,3H)-dione
group of stereoisomers with the chemical formula C₉H₁₂N₂O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
246.082089596
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₁₂N₂O₆
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
[2H]c1c(O)nc(=O)n(C2OC(CO)C(O)C2O)c1[2H]
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
[2H]c1c(O)nc(=O)n([C@@H]2O[C@H](CO)[C@H](O)C2O)c1[2H]
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C9H12N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6+,7?,8-/m1/s1/i1D,2D
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InChIKey
DRTQHJPVMGBUCF-TTYVMISXSA-N
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CAS Registry Number
40632-21-1
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PubChem CID
46783218
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
23122164
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70676190
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DSSTOX compound identifier
DTXCID30626939
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