GD000479

Name:

None

Formula:

C15H28O14N7P3S

Smiles:

NC(CCS[C@H](CNP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H]1OC(n2cnc3c2NC=NC3N)[C@H](O)[C@H]1O)C(=O)O

Aglycone:

NC(CCSCCNP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(=O)O.NC1N=CNC2=C1N=C[N]2

Sugarmoiety:

OC1OC(O)C(O)C1O

Other Identifiers

• CHEMBL606493

AD00536

Formula: C6H17O11N2P3S

Smiles:

NC(CCSCCNP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(=O)O

HBA:	13	RingCount:	0
HBD:	8	FractionCSP3:	0.83
AlogP:	-0.56	Num_rotatable_bonds:	12
MolWt:	418.19	Num_heavy_atoms:	23
TPSA:	225.94	NumAromaticRings:	0

AD00537

Formula: C5H6N5

Smiles:

NC1N=CNC2=C1N=C[N]2

HBA:	5	RingCount:	2
HBD:	3	FractionCSP3:	0.2
AlogP:	-1.28	Num_rotatable_bonds:	0
MolWt:	136.14	Num_heavy_atoms:	10
TPSA:	76.87	NumAromaticRings:	0