GD032165

Name:

None

Formula:

C23H27O11N7

Smiles:

O=C(NC[C@@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@H]1O)c1cccc(-c2cn([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nn2)n1

Aglycone:

CNC(=O)c1cccc(C2=C[N]N=N2)n1.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:

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

Other Identifiers

• CHEMBL3596227

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

AD20652

Formula: C9H8ON5

Smiles:

CNC(=O)c1cccc(C2=C[N]N=N2)n1

HBA:	6	RingCount:	2
HBD:	1	FractionCSP3:	0.11
AlogP:	0.72	Num_rotatable_bonds:	2
MolWt:	202.2	Num_heavy_atoms:	15
TPSA:	80.81	NumAromaticRings:	1