GD035278

Name:

None

Formula:

C45H60O24N20P4S4

Smiles:

Nc1ncnc2c1ncn2[C@H]1O[C@@H](COP(=O)(S)OCC(COP(=O)(S)OC[C@@H]2O[C@H](n3cnc4c(N)ncnc43)[C@H](O)[C@H]2O)(COP(=O)(S)OC[C@@H]2O[C@H](n3cnc4c(N)ncnc43)[C@H](O)[C@H]2O)COP(=O)(S)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O

Aglycone:

COP(=O)(S)OCC(COP(=O)(S)OC)(COP(=O)(S)OC)COP(=O)(S)OC.Nc1ncnc2c1N=C[N]2.Nc1ncnc2c1N=C[N]2.Nc1ncnc2c1N=C[N]2.Nc1ncnc2c1N=C[N]2

Sugarmoiety:

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

Other Identifiers

• CHEMBL1812068

AD00058

Formula: C5H4N5

Smiles:

Nc1ncnc2c1N=C[N]2

HBA:	5	RingCount:	2
HBD:	2	FractionCSP3:	0.0
AlogP:	-0.03	Num_rotatable_bonds:	0
MolWt:	134.12	Num_heavy_atoms:	10
TPSA:	78.26	NumAromaticRings:	1

AD22331

Formula: C9H24O12P4S4

Smiles:

COP(=O)(S)OCC(COP(=O)(S)OC)(COP(=O)(S)OC)COP(=O)(S)OC

HBA:	12	RingCount:	0
HBD:	0	FractionCSP3:	1.0
AlogP:	4.78	Num_rotatable_bonds:	16
MolWt:	576.44	Num_heavy_atoms:	29
TPSA:	142.12	NumAromaticRings:	0