GD020842

Name:

None

Formula:

C26H37O16N10P4ClS4

Smiles:

CCSc1nc(N)c2ncn([C@H]3O[C@@H](COP(=O)(S)OP(=O)(O)C(Cl)P(=O)(O)OP(=O)(S)OC[C@H]4O[C@@H](n5cnc6c(N)nc(SCC)nc65)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)c2n1

Aglycone:

CCSc1nc(N)c2c(n1)[N]C=N2.CCSc1nc(N)c2c(n1)[N]C=N2.COP(=O)(S)OP(=O)(O)C(Cl)P(=O)(O)OP(=O)(S)OC

Sugarmoiety:

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

Other Identifiers

• CHEMBL3747869

AD00071

Formula: C7H8N5S

Smiles:

CCSc1nc(N)c2c(n1)[N]C=N2

HBA:	5	RingCount:	2
HBD:	2	FractionCSP3:	0.29
AlogP:	1.08	Num_rotatable_bonds:	2
MolWt:	194.24	Num_heavy_atoms:	13
TPSA:	78.26	NumAromaticRings:	1

AD03334

Formula: C4H11O10P4ClS2

Smiles:

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

HBA:	10	RingCount:	0
HBD:	2	FractionCSP3:	1.0
AlogP:	3.28	Num_rotatable_bonds:	8
MolWt:	430.59	Num_heavy_atoms:	20
TPSA:	145.66	NumAromaticRings:	0