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(Q82440274)
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English
5'-O-(Dichlorophosphoryl)adenosine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
purine nucleotides
1 reference
based on heuristic
inferred from SMILES
mass
382.995310474
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₀H₁₂Cl₂N₅O₅P
0 references
canonical SMILES
Nc1ncnc2c1ncn2C1OC(COP(=O)(Cl)Cl)C(O)C1O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(Cl)Cl)O)O)N
0 references
Identifiers
InChI
InChI=1S/C10H12Cl2N5O5P/c11-23(12,20)21-1-4-6(18)7(19)10(22-4)17-3-16-5-8(13)14-2-15-9(5)17/h2-4,6-7,10,18-19H,1H2,(H2,13,14,15)/t4-,6-,7-,10-/m1/s1
0 references
InChIKey
CXFQFFBLOSCANA-KQYNXXCUSA-N
0 references
CAS Registry Number
34051-17-7
0 references
PubChem CID
14258187
1 reference
matched by identifier from
InChIKey
InChIKey
CXFQFFBLOSCANA-KQYNXXCUSA-N
UniChem compound ID
26418654
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40558111
1 reference
matched by identifier from
InChIKey
InChIKey
CXFQFFBLOSCANA-KQYNXXCUSA-N
DSSTOX compound identifier
DTXCID80508892
0 references
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