GD027951

Name:

None

Formula:

C17H30O12N5P3S

Smiles:

CCCCCCSc1nc(N)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)CP(=O)(O)O)[C@H](O)[C@H]3O)c2n1

Aglycone:

CCCCCCSc1nc(N)c2c(n1)[N]C=N2.COP(=O)(O)OP(=O)(O)CP(=O)(O)O

Sugarmoiety:

OC1OC(O)C(O)C1O

Other Identifiers

• CHEMBL3314932

AD00286

Formula: C11H16N5S

Smiles:

CCCCCCSc1nc(N)c2c(n1)[N]C=N2

HBA:	5	RingCount:	2
HBD:	2	FractionCSP3:	0.55
AlogP:	2.64	Num_rotatable_bonds:	6
MolWt:	250.35	Num_heavy_atoms:	17
TPSA:	78.26	NumAromaticRings:	1

AD06058

Formula: C2H9O9P3

Smiles:

COP(=O)(O)OP(=O)(O)CP(=O)(O)O

HBA:	9	RingCount:	0
HBD:	4	FractionCSP3:	1.0
AlogP:	0.07	Num_rotatable_bonds:	5
MolWt:	270.01	Num_heavy_atoms:	14
TPSA:	150.59	NumAromaticRings:	0