GD092076

Name:

None

Formula:

C19H24O8N5

Smiles:

CC(=O)OC[C@H]1O[C@@H](n2cnc3c(OC4C[NH2+]C4)ncnc32)[C@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:

C1=Nc2c(ncnc2OC2C[NH2+]C2)[N]1.COC(C)=O

Sugarmoiety:

CC(=O)OC1C(O)OC(O)C1OC(C)=O

Other Identifiers

• ZINC001218049100

AD00017

Formula: C3H6O2

Smiles:

COC(C)=O

HBA:	2	RingCount:	0
HBD:	0	FractionCSP3:	0.67
AlogP:	0.18	Num_rotatable_bonds:	0
MolWt:	74.08	Num_heavy_atoms:	5
TPSA:	26.3	NumAromaticRings:	0

AD40199

Formula: C8H9ON5

Smiles:

C1=Nc2c(ncnc2OC2C[NH2+]C2)[N]1

HBA:	6	RingCount:	3
HBD:	2	FractionCSP3:	0.38
AlogP:	-1.29	Num_rotatable_bonds:	2
MolWt:	191.19	Num_heavy_atoms:	14
TPSA:	78.08	NumAromaticRings:	1