GD110140

Name:

None

Formula:

C33H34O16

Smiles:

COc1ccc(-c2coc3ccc(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(OC(C)=O)c3c2=O)cc1OC

Aglycone:

COC(C)=O.COc1ccc(-c2coc3ccc(O)c(OC(C)=O)c3c2=O)cc1OC

Sugarmoiety:

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

Other Identifiers

• ZINC000585162778

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

AD44618

Formula: C19H16O7

Smiles:

COc1ccc(-c2coc3ccc(O)c(OC(C)=O)c3c2=O)cc1OC

HBA:	7	RingCount:	3
HBD:	1	FractionCSP3:	0.16
AlogP:	3.11	Num_rotatable_bonds:	4
MolWt:	356.33	Num_heavy_atoms:	26
TPSA:	95.2	NumAromaticRings:	3