Base information

Cat. No.
CAS No.112571-68-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C12H48N6O30P6
Molecular Weight 942.374
Exact Mass 942.084
XLogP3 -2.0808
Mr 163.802
PSA 597.78
Sequence -
Atom number 102
Bond number 96
Ring number 2
Rotor number 12
Residues number 0
Canonical smiles [O-][C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]([C@@H]([C@@H]1[O-])OP(=O)(O)O)[O-].[O-][C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]([C@@H]([C@@H]1[O-])OP(=O)(O)O)[O-].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+]

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