Base information

Cat. No.
CAS No.53-84-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C21H27N7O14P2
Molecular Weight 663.425
Exact Mass 663.109
XLogP3 -1.2962
Mr 139.422
PSA 340.71
Sequence -
Atom number 71
Bond number 75
Ring number 5
Rotor number 11
Residues number 0
Canonical smiles O[C@@H]1[C@@H](COP(=O)(OP(=O)(OC[C@H]2O[C@H]([C@@H]([C@@H]2O)O)n2cnc3c2ncnc3N)O)[O-])O[C@H]([C@@H]1O)[n+]1cccc(c1)C(=O)N

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