GD107188

Name:

None

Formula:

C31H41O16N

Smiles:

COc1ccc([C@H]2OC[C@H]3O[C@H](OC)[C@H](NC(C)=O)[C@@H](O[C@@H]4O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]4OC(C)=O)[C@H]3O2)cc1

Aglycone:

COC(C)=O.COc1ccc(C2OCC3OC(OC)C(NC(C)=O)C(O)C3O2)cc1

Sugarmoiety:

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

Other Identifiers

• ZINC000077302497

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

AD44289

Formula: C17H23O7N

Smiles:

COc1ccc(C2OCC3OC(OC)C(NC(C)=O)C(O)C3O2)cc1

HBA:	8	RingCount:	3
HBD:	2	FractionCSP3:	0.59
AlogP:	0.35	Num_rotatable_bonds:	4
MolWt:	353.37	Num_heavy_atoms:	25
TPSA:	95.48	NumAromaticRings:	1