GD007353

Name:

None

Formula:

C11H18O13N5P3S

Smiles:

C[n+]1cn([C@@H]2O[C@H](CO[P@@](=O)(S)OP(=O)([O-])OP(=O)(O)O)[C@H](O)[C@H]2O)c2nc(N)nc(O)c21

Aglycone:

COP(=O)(S)OP(=O)([O-])OP(=O)(O)O.C[N+]1=C[N]c2nc(N)nc(O)c21

Sugarmoiety:

OC1OC(O)C(O)C1O

Other Identifiers

• CHEMBL3351004
• CHEMBL3604542
• CHEMBL3604543
• CHEMBL4298698

AD02044

Formula: C6H7ON5

Smiles:

C[N+]1=C[N]c2nc(N)nc(O)c21

HBA:	6	RingCount:	2
HBD:	3	FractionCSP3:	0.17
AlogP:	-0.68	Num_rotatable_bonds:	0
MolWt:	165.16	Num_heavy_atoms:	12
TPSA:	89.14	NumAromaticRings:	1

AD05998

Formula: CH6O9P3S

Smiles:

COP(=O)(S)OP(=O)([O-])OP(=O)(O)O

HBA:	9	RingCount:	0
HBD:	2	FractionCSP3:	1.0
AlogP:	0.26	Num_rotatable_bonds:	5
MolWt:	287.04	Num_heavy_atoms:	14
TPSA:	142.42	NumAromaticRings:	0