GD017179

Name:

None

Formula:

C25H38O21N8P2

Smiles:

Nc1nc2c(ncn2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OCc3cn([C@@H]4O[C@H](CO)[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)nn3)[C@H](O)[C@H]2O)c(=O)[nH]1

Aglycone:

COP(=O)(O)OP(=O)(O)OCC1=C[N]N=N1.Nc1nc2c(c(=O)[nH]1)N=C[N]2

Sugarmoiety:

OC1OC(O)C(O)C1O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL3558490

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

AD02713

Formula: C4H8O7N3P2

Smiles:

COP(=O)(O)OP(=O)(O)OCC1=C[N]N=N1

HBA:	10	RingCount:	1
HBD:	2	FractionCSP3:	0.5
AlogP:	0.69	Num_rotatable_bonds:	6
MolWt:	272.07	Num_heavy_atoms:	16
TPSA:	141.11	NumAromaticRings:	0