GD035460

Name:

None

Formula:

C53H94O30

Smiles:

CCCCCC[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](O[C@@H]3O[C@H](CO[C@@H]4O[C@H](C)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H](O)[C@H]3O)[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:

CCCCCCC(O)CCCCCCCCCC(=O)O

Sugarmoiety:

CC1OC(OCC2OC(OC3C(CO)OC(OC4C(O)C(CO)OC(OC5C(O)OC(C)C(O)C5O)C4OC4OC(C)C(O)C(O)C4O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL4474786

AD09746

Formula: C17H34O3

Smiles:

CCCCCCC(O)CCCCCCCCCC(=O)O

HBA:	3	RingCount:	0
HBD:	2	FractionCSP3:	0.94
AlogP:	4.91	Num_rotatable_bonds:	15
MolWt:	286.46	Num_heavy_atoms:	20
TPSA:	57.53	NumAromaticRings:	0