GD076904

Name:

None

Formula:

C16H18O8N4

Smiles:

CC(=O)OC[C@H]1O[C@H](n2cnc3c(=O)[nH]cnc32)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:

COC(C)=O.O=c1[nH]cnc2c1N=C[N]2

Sugarmoiety:

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

Other Identifiers

• ZINC000017324721

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

AD01144

Formula: C5H3ON4

Smiles:

O=c1[nH]cnc2c1N=C[N]2

HBA:	5	RingCount:	2
HBD:	1	FractionCSP3:	0.0
AlogP:	-0.32	Num_rotatable_bonds:	0
MolWt:	135.11	Num_heavy_atoms:	10
TPSA:	72.21	NumAromaticRings:	1