GD106820

Name:

None

Formula:

C25H31O12N

Smiles:

CC(=O)OC[C@@H]1O[C@@H](Oc2ccc(C(=O)N3CCOCC3)cc2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

COC(C)=O.O=C(c1ccc(O)cc1)N1CCOCC1

Sugarmoiety:

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

Other Identifiers

• ZINC000008497312

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

AD44224

Formula: C11H13O3N

Smiles:

O=C(c1ccc(O)cc1)N1CCOCC1

HBA:	4	RingCount:	2
HBD:	1	FractionCSP3:	0.36
AlogP:	0.86	Num_rotatable_bonds:	1
MolWt:	207.23	Num_heavy_atoms:	15
TPSA:	49.77	NumAromaticRings:	1