GD028906

Name:

None

Formula:

C58H102O35

Smiles:

CCCCC[C@H](CCCCCCCCCC(=O)O)O[C@@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@H](O[C@@H]4O[C@H](CO[C@@H]5O[C@H](C)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)[C@H]1O[C@@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

CCCCCC(O)CCCCCCCCCC(=O)O

Sugarmoiety:

CC1OC(OCC2OC(OC3C(CO)OC(OCC4OC(OC5C(O)C(CO)OC(OC6C(O)OC(C)C(O)C6O)C5OC5OC(C)C(O)C(O)C5O)C(O)C(O)C4O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL4568170

AD02342

Formula: C16H32O3

Smiles:

CCCCCC(O)CCCCCCCCCC(=O)O

HBA:	3	RingCount:	0
HBD:	2	FractionCSP3:	0.94
AlogP:	4.52	Num_rotatable_bonds:	14
MolWt:	272.43	Num_heavy_atoms:	19
TPSA:	57.53	NumAromaticRings:	0