GD067746

Name:

None

Formula:

C15H20O9N2

Smiles:

CC(=O)OC[C@@H]1O[C@H](N2CCC(=O)NC2=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

COC(C)=O.O=C1CCNC(=O)N1

Sugarmoiety:

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

Other Identifiers

• ZINC000261492869

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

AD01822

Formula: C4H6O2N2

Smiles:

O=C1CCNC(=O)N1

HBA:	4	RingCount:	1
HBD:	2	FractionCSP3:	0.5
AlogP:	-0.78	Num_rotatable_bonds:	0
MolWt:	114.1	Num_heavy_atoms:	8
TPSA:	58.2	NumAromaticRings:	0