GD016000

Name:

None

Formula:

C22H32O22N3FP4

Smiles:

O=c1[nH]c(=NOCc2ccccc2)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O[C@@H]2O[C@H](CO)[C@H](O)[C@H](F)[C@H]2O)[C@H](O)[C@H]1O

Aglycone:

COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O.O=c1[nH]ccc(=NOCc2ccccc2)[nH]1

Sugarmoiety:

OC1OC(O)C(O)C1O.OCC1OC(O)C(O)C(F)C1O

Other Identifiers

• CHEMBL1784291

AD01690

Formula: CH8O13P4

Smiles:

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

HBA:	13	RingCount:	0
HBD:	5	FractionCSP3:	1.0
AlogP:	0.08	Num_rotatable_bonds:	7
MolWt:	351.96	Num_heavy_atoms:	18
TPSA:	206.35	NumAromaticRings:	0

AD09607

Formula: C11H11O2N3

Smiles:

O=c1[nH]ccc(=NOCc2ccccc2)[nH]1

HBA:	5	RingCount:	2
HBD:	2	FractionCSP3:	0.09
AlogP:	0.74	Num_rotatable_bonds:	3
MolWt:	217.23	Num_heavy_atoms:	16
TPSA:	70.24	NumAromaticRings:	2