GD097945

Name:

None

Formula:

C20H24O10N4

Smiles:

CC[C@H](O)C(=O)Oc1ncnc2c1ncn2[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

CCC(O)C(=O)Oc1ncnc2c1N=C[N]2.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• ZINC001227662771

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

AD41659

Formula: C9H9O3N4

Smiles:

CCC(O)C(=O)Oc1ncnc2c1N=C[N]2

HBA:	7	RingCount:	2
HBD:	1	FractionCSP3:	0.33
AlogP:	0.06	Num_rotatable_bonds:	3
MolWt:	221.2	Num_heavy_atoms:	16
TPSA:	98.77	NumAromaticRings:	1