GD144095

Name:

Thalictoside F

Formula:

C65H108O32

Smiles:

CC1OC(OCC2OC(OC3CCC45CC46CCC4(C)C(C7C(OC8OC(COC9OCC(O)C(O)C9O)C(O)C(O)C8OC8OC(CO)C(O)C(O)C8O)CC(C(C)(C)O)C7O)CCC4(C)C6CCC5C3(C)CO)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O

Aglycone:

CC(C)(O)C1CC(O)C(C2CCC3(C)C4CCC5C(C)(CO)C(O)CCC56CC46CCC23C)C1O

Sugarmoiety:

CC1OC(OCC2OC(O)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O.OCC1OC(OC2C(O)OC(COC3OCC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CNP0304184

AD56363

Formula: C30H50O5

Smiles:

CC(C)(O)C1CC(O)C(C2CCC3(C)C4CCC5C(C)(CO)C(O)CCC56CC46CCC23C)C1O

HBA:	5	RingCount:	6
HBD:	5	FractionCSP3:	1.0
AlogP:	3.89	Num_rotatable_bonds:	3
MolWt:	490.73	Num_heavy_atoms:	35
TPSA:	101.15	NumAromaticRings:	0