GD104245

Name:

None

Formula:

C24H30O11

Smiles:

CC(=O)OC[C@@H]1O[C@H](OC(=O)c2c(C)cc(C)cc2C)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:

COC(C)=O.Cc1cc(C)c(C(=O)O)c(C)c1

Sugarmoiety:

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

Other Identifiers

• ZINC000257347150

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

AD29370

Formula: C10H12O2

Smiles:

Cc1cc(C)c(C(=O)O)c(C)c1

HBA:	2	RingCount:	1
HBD:	1	FractionCSP3:	0.3
AlogP:	2.31	Num_rotatable_bonds:	1
MolWt:	164.2	Num_heavy_atoms:	12
TPSA:	37.3	NumAromaticRings:	1