GD007247

Name:

None

Formula:

C27H39O20NS

Smiles:

CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1CO[C@@H]1O[C@H](COS(N)(=O)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

COC(C)=O.COS(N)(=O)=O

Sugarmoiety:

CC(=O)OC1OC(O)C(COC2OC(O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

• CHEMBL2337521

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

AD00036

Formula: CH5O3NS

Smiles:

COS(N)(=O)=O

HBA:	4	RingCount:	0
HBD:	2	FractionCSP3:	1.0
AlogP:	-1.16	Num_rotatable_bonds:	1
MolWt:	111.12	Num_heavy_atoms:	6
TPSA:	69.39	NumAromaticRings:	0