GD113864

Name:

None

Formula:

C32H33O9FS

Smiles:

CC(=O)OC[C@H]1O[C@@H](c2ccc(C)c(Cc3ccc(-c4ccc(F)cc4)s3)c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:

COC(C)=O.Cc1ccccc1Cc1ccc(-c2ccc(F)cc2)s1

Sugarmoiety:

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

Other Identifiers

• ZINC000059148899

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

AD05822

Formula: C18H15FS

Smiles:

Cc1ccccc1Cc1ccc(-c2ccc(F)cc2)s1

HBA:	0	RingCount:	3
HBD:	0	FractionCSP3:	0.11
AlogP:	5.45	Num_rotatable_bonds:	3
MolWt:	282.38	Num_heavy_atoms:	20
TPSA:	0.0	NumAromaticRings:	3