GD016807

Name:

None

Formula:

C52H94O35S16

Smiles:

O=S(=O)([O-])CCSCCCOC[C@@H]1O[C@H](O[C@@]2(COCCCSCCS(=O)(=O)[O-])O[C@H](COCCCSCCS(=O)(=O)[O-])[C@H](OCCCSCCS(=O)(=O)[O-])[C@H]2OCCCSCCS(=O)(=O)[O-])[C@H](OCCCSCCS(=O)(=O)[O-])[C@H](OCCCSCCS(=O)(=O)[O-])[C@H]1OCCCSCCS(=O)(=O)[O-]

Aglycone:

COCCCSCCS(=O)(=O)[O-].COCCCSCCS(=O)(=O)[O-].COCCCSCCS(=O)(=O)[O-].O=S(=O)([O-])CCSCCCO.O=S(=O)([O-])CCSCCCO.O=S(=O)([O-])CCSCCCO.O=S(=O)([O-])CCSCCCO.O=S(=O)([O-])CCSCCCO

Sugarmoiety:

OC1OC(OC2(O)OC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL3142956

AD00994

Formula: C6H13O4S2

Smiles:

COCCCSCCS(=O)(=O)[O-]

HBA:	4	RingCount:	0
HBD:	0	FractionCSP3:	1.0
AlogP:	0.3	Num_rotatable_bonds:	7
MolWt:	213.3	Num_heavy_atoms:	12
TPSA:	66.43	NumAromaticRings:	0

AD00995

Formula: C5H11O4S2

Smiles:

O=S(=O)([O-])CCSCCCO

HBA:	4	RingCount:	0
HBD:	1	FractionCSP3:	1.0
AlogP:	-0.35	Num_rotatable_bonds:	6
MolWt:	199.27	Num_heavy_atoms:	11
TPSA:	77.43	NumAromaticRings:	0