GD108534

Name:

None

Formula:

C18H29O15N6P3

Smiles:

C[C@H](O[PH](O)(O)O[PH](O)(O)O[PH](O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O)c1ccccc1[N+](=O)[O-]

Aglycone:

CO[PH](O)(O)O[PH](O)(O)O[PH](O)(O)OC(C)c1ccccc1[N+](=O)[O-].Nc1ncnc2c1N=C[N]2

Sugarmoiety:

OC1OC(O)C(O)C1O

Other Identifiers

• ZINC000098208638

AD00058

Formula: C5H4N5

Smiles:

Nc1ncnc2c1N=C[N]2

HBA:	5	RingCount:	2
HBD:	2	FractionCSP3:	0.0
AlogP:	-0.03	Num_rotatable_bonds:	0
MolWt:	134.12	Num_heavy_atoms:	10
TPSA:	78.26	NumAromaticRings:	1

AD44262

Formula: C9H20O12NP3

Smiles:

CO[PH](O)(O)O[PH](O)(O)O[PH](O)(O)OC(C)c1ccccc1[N+](=O)[O-]

HBA:	13	RingCount:	1
HBD:	6	FractionCSP3:	0.33
AlogP:	0.54	Num_rotatable_bonds:	9
MolWt:	427.18	Num_heavy_atoms:	25
TPSA:	201.44	NumAromaticRings:	1