GD098322

Name:

None

Formula:

C19H27O10N3

Smiles:

CC(=O)OC[C@H]1O[C@H](O)[C@H](n2cc(C(=O)OC(C)(C)C)nn2)[C@@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

CC(C)(C)OC(=O)C1=C[N]N=N1.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• ZINC001254112492

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

AD28746

Formula: C7H10O2N3

Smiles:

CC(C)(C)OC(=O)C1=C[N]N=N1

HBA:	5	RingCount:	1
HBD:	0	FractionCSP3:	0.57
AlogP:	1.15	Num_rotatable_bonds:	1
MolWt:	168.18	Num_heavy_atoms:	12
TPSA:	65.12	NumAromaticRings:	0