GD106509

Name:

None

Formula:

C24H32O15

Smiles:

CC(=O)OC[C@H]1OC=C[C@H](OC(C)=O)[C@@H]1O[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

CC(=O)OCC1OC=CC(OC(C)=O)C1O.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• ZINC000103665846

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

AD44146

Formula: C10H14O6

Smiles:

CC(=O)OCC1OC=CC(OC(C)=O)C1O

HBA:	6	RingCount:	1
HBD:	1	FractionCSP3:	0.6
AlogP:	-0.25	Num_rotatable_bonds:	3
MolWt:	230.22	Num_heavy_atoms:	16
TPSA:	82.06	NumAromaticRings:	0