GD154366

Name:

None

Formula:

C40H64O17S

Smiles:

CC(C)(O)CCCC1(C)OC(=O)C23C(O)C=C4C(CCC5C4(C)CCC(OC4OCC(OS(=O)(=O)O)C(O)C4OC4OCC(O)C(O)C4O)C5(C)C)C2(C)CCC13O

Aglycone:

CC(C)(O)CCCC1(C)OC(=O)C23C(O)C=C4C(CCC5C4(C)CCC(O)C5(C)C)C2(C)CCC13O.O=S(=O)(O)O

Sugarmoiety:

OC1COC(OC2C(O)OCC(O)C2O)C(O)C1O

Other Identifiers

• CNP0474958

AD00034

Formula: H2O4S

Smiles:

O=S(=O)(O)O

HBA:	4	RingCount:	0
HBD:	2	FractionCSP3:	0.0
AlogP:	-0.65	Num_rotatable_bonds:	0
MolWt:	98.08	Num_heavy_atoms:	5
TPSA:	74.6	NumAromaticRings:	0

AD50991

Formula: C30H48O6

Smiles:

CC(C)(O)CCCC1(C)OC(=O)C23C(O)C=C4C(CCC5C4(C)CCC(O)C5(C)C)C2(C)CCC13O

HBA:	6	RingCount:	5
HBD:	4	FractionCSP3:	0.9
AlogP:	4.28	Num_rotatable_bonds:	4
MolWt:	504.71	Num_heavy_atoms:	36
TPSA:	107.22	NumAromaticRings:	0