GD033322

Name:

None

Formula:

C39H48O20

Smiles:

CC(=O)O[C@@H]1[C@H](OC(C)=O)C[C@](OC(=O)C=Cc2ccccc2)(C(=O)OCc2ccccc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C[C@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

CC(=O)OC1CC(OC(=O)C=Cc2ccccc2)(C(=O)OCc2ccccc2O)CC(O)C1OC(C)=O

Sugarmoiety:

OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

• CHEMBL4874016

AD21281

Formula: C27H28O10

Smiles:

CC(=O)OC1CC(OC(=O)C=Cc2ccccc2)(C(=O)OCc2ccccc2O)CC(O)C1OC(C)=O

HBA:	10	RingCount:	3
HBD:	2	FractionCSP3:	0.33
AlogP:	2.45	Num_rotatable_bonds:	8
MolWt:	512.51	Num_heavy_atoms:	37
TPSA:	145.66	NumAromaticRings:	2