GD024802

Name:

None

Formula:

C26H26O11Cl2

Smiles:

CC(=O)OC[C@@H]1O[C@H](CC(=O)C=Cc2cc(Cl)cc(Cl)c2O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

CC(=O)C=Cc1cc(Cl)cc(Cl)c1O.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• CHEMBL3793147

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

AD16519

Formula: C12H8O2Cl2

Smiles:

CC(=O)C=Cc1cc(Cl)cc(Cl)c1O

HBA:	2	RingCount:	1
HBD:	1	FractionCSP3:	0.1
AlogP:	3.3	Num_rotatable_bonds:	2
MolWt:	231.08	Num_heavy_atoms:	14
TPSA:	37.3	NumAromaticRings:	1