GD106068

Name:

None

Formula:

C18H35O21N5P4

Smiles:

Nc1ccn([C@H]2C[C@H](O)[C@@H](CO[PH](O)(O)O[PH](O)(O)O[PH](O)(O)O[PH](O)(O)OC[C@H]3O[C@@H](n4ccc(=O)[nH]c4=O)[C@H](O)[C@@H]3O)O2)c(=O)n1

Aglycone:

CO[PH](O)(O)O[PH](O)(O)O[PH](O)(O)O[PH](O)(O)OCC1OC(n2ccc(N)nc2=O)CC1O.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:

OC1OC(O)C(O)C1O

Other Identifiers

• ZINC000085540154

AD00106

Formula: C4H4O2N2

Smiles:

O=c1cc[nH]c(=O)[nH]1

HBA:	4	RingCount:	1
HBD:	2	FractionCSP3:	0.0
AlogP:	-0.94	Num_rotatable_bonds:	0
MolWt:	112.09	Num_heavy_atoms:	8
TPSA:	65.72	NumAromaticRings:	1

AD44107

Formula: C10H27O16N3P4

Smiles:

CO[PH](O)(O)O[PH](O)(O)O[PH](O)(O)O[PH](O)(O)OCC1OC(n2ccc(N)nc2=O)CC1O

HBA:	19	RingCount:	2
HBD:	11	FractionCSP3:	0.6
AlogP:	-3.24	Num_rotatable_bonds:	11
MolWt:	569.23	Num_heavy_atoms:	33
TPSA:	298.36	NumAromaticRings:	1