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(Q82939252)
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English
9-[3,4,6-Tri-O-acetyl-2-deoxy-2-(2,4-dinitroanilino)hexopyranosyl]-9H-purin-6-amine
chemical compound
9-{3,4,6-tri-o-acetyl-2-deoxy-2-[(2,4-dinitrophenyl)amino]hexopyranosyl}-9h-purin-6-amine
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
588.156453588
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₂₄N₈O₁₁
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(=O)OCC1OC(n2cnc3c(N)ncnc32)C(Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C(OC(C)=O)C1OC(C)=O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C23H24N8O11/c1-10(32)39-7-16-19(40-11(2)33)20(41-12(3)34)17(28-14-5-4-13(30(35)36)6-15(14)31(37)38)23(42-16)29-9-27-18-21(24)25-8-26-22(18)29/h4-6,8-9,16-17,19-20,23,28H,7H2,1-3H3,(H2,24,25,26)
0 references
InChIKey
DLXOWGSBNBQMMR-UHFFFAOYSA-N
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CAS Registry Number
3768-25-0
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3758-60-9
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PubChem CID
258661
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
42061162
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00958719
0 references
DTXSID70293220
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DSSTOX compound identifier
DTXCID90951971
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DTXCID40244360
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NSC number
87919
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87918
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