GD110354

Name:

None

Formula:

C32H40O15

Smiles:

COC(=O)CC/C(C)=C/Cc1c(OC)c(C)c2c(c1O[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)C(=O)OC2

Aglycone:

COC(=O)CCC(C)=CCc1c(O)c2c(c(C)c1OC)COC2=O.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• ZINC000077311505

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

AD04051

Formula: C18H22O6

Smiles:

COC(=O)CCC(C)=CCc1c(O)c2c(c(C)c1OC)COC2=O

HBA:	6	RingCount:	2
HBD:	1	FractionCSP3:	0.44
AlogP:	2.82	Num_rotatable_bonds:	6
MolWt:	334.37	Num_heavy_atoms:	24
TPSA:	82.06	NumAromaticRings:	1