GD005691

Name:

None

Formula:

C25H32O16N10P4Cl2S4

Smiles:

CSc1nc(N)c2ncn([C@H]3O[C@@H](COP(=O)(S)OP(=O)(O)C(Cl)(Cl)P(=O)(O)OP(=O)(S)OC[C@H]4O[C@@H](n5cnc6c(N)nc(SC)nc65)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)c2n1

Aglycone:

COP(=O)(S)OP(=O)(O)C(Cl)(Cl)P(=O)(O)OP(=O)(S)OC.CSc1nc(N)c2c(n1)[N]C=N2.CSc1nc(N)c2c(n1)[N]C=N2

Sugarmoiety:

OC1OC(O)C(O)C1O.OC1OC(O)C(O)C1O

Other Identifiers

• CHEMBL3747879

AD00851

Formula: C6H6N5S

Smiles:

CSc1nc(N)c2c(n1)[N]C=N2

HBA:	5	RingCount:	2
HBD:	2	FractionCSP3:	0.17
AlogP:	0.69	Num_rotatable_bonds:	1
MolWt:	180.22	Num_heavy_atoms:	12
TPSA:	78.26	NumAromaticRings:	1

AD04795

Formula: C5H10O10P4Cl2S2

Smiles:

COP(=O)(S)OP(=O)(O)C(Cl)(Cl)P(=O)(O)OP(=O)(S)OC

HBA:	10	RingCount:	0
HBD:	2	FractionCSP3:	1.0
AlogP:	3.85	Num_rotatable_bonds:	8
MolWt:	465.04	Num_heavy_atoms:	21
TPSA:	145.66	NumAromaticRings:	0