GD105734

Name:

None

Formula:

C19H26O13N7P

Smiles:

Nc1nc2c(ncn2[C@@H]2O[C@H](CO)[C@H](O[PH](O)(O)OC[C@@H]3O[C@H](n4ccc(=O)[nH]c4=O)[C@H](O)[C@H]3O)[C@H]2O)c(=O)[nH]1

Aglycone:

CO[PH](O)(O)O.Nc1nc2c(c(=O)[nH]1)N=C[N]2.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:

OCC1OC(O)C(O)C1O.OCC1OC(O)C(O)O1

Other Identifiers

• ZINC000256673682

AD00106

Formula: C4H4O2N2

Smiles:

O=c1cc[nH]c(=O)[nH]1

HBA:	4	RingCount:	1
HBD:	2	FractionCSP3:	0.0
AlogP:	-0.94	Num_rotatable_bonds:	0
MolWt:	112.09	Num_heavy_atoms:	8
TPSA:	65.72	NumAromaticRings:	1

AD00207

Formula: C5H4ON5

Smiles:

Nc1nc2c(c(=O)[nH]1)N=C[N]2

HBA:	6	RingCount:	2
HBD:	3	FractionCSP3:	0.0
AlogP:	-0.74	Num_rotatable_bonds:	0
MolWt:	150.12	Num_heavy_atoms:	11
TPSA:	98.23	NumAromaticRings:	1

AD01852

Formula: CH7O4P

Smiles:

CO[PH](O)(O)O

HBA:	4	RingCount:	0
HBD:	3	FractionCSP3:	1.0
AlogP:	-0.98	Num_rotatable_bonds:	1
MolWt:	114.04	Num_heavy_atoms:	6
TPSA:	69.92	NumAromaticRings:	0