GD106490

Name:

None

Formula:

C23H32O14

Smiles:

CC(=O)OC[C@H]1O[C@@H](O[C@@H]2[C@@H]3OC(C)(C)O[C@H]3[C@@H]3OC[C@H]2O3)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

CC1(C)OC2C3OCC(O3)C(O)C2O1.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• ZINC000004403073

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

AD44184

Formula: C9H14O5

Smiles:

CC1(C)OC2C3OCC(O3)C(O)C2O1

HBA:	5	RingCount:	3
HBD:	1	FractionCSP3:	1.0
AlogP:	-0.38	Num_rotatable_bonds:	0
MolWt:	202.21	Num_heavy_atoms:	14
TPSA:	57.15	NumAromaticRings:	0